1-carbamimidoyl-2-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(5-methylcyclopenten-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(3-methyl-2,3-dihydrofuran-4-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(5-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[2-(4-methylfuran-3-yl)ethyl]guanidine;1,1-dimethyl-3-[N'-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-3-[N'-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-3-[N'-[2-(5-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-2-[N'-[2-(4-methylfuran-3-yl)ethyl]carbamimidoyl]guanidine

C129H226N60O3 — CID 176541363

IUPAC1-carbamimidoyl-2-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(5-methylcyclopenten-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(3-methyl-2,3-dihydrofuran-4-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(5-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[2-(4-methylfuran-3-yl)ethyl]guanidine;1,1-dimethyl-3-[N'-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-3-[N'-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-3-[N'-[2-(5-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-2-[N'-[2-(4-methylfuran-3-yl)ethyl]carbamimidoyl]guanidine
SMILESCc1cocc1CC/N=C(\N)N=C(N)N(C)C.[H]/N=C(/N/C(N)=N/CCC1=C(C)CC=C1)N(C)C.[H]/N=C(/N/C(N)=N/CCC1=CCC(C)=C1)N(C)C.[H]/N=C(/N/C(N)=N/CCC1=CCC=C1C)N(C)C.[H]/N=C(/N=C(N)N)N(C)CCc1cocc1C.[H]/N=C(\N)N/C(N)=N/CCC1=C(C)CC=C1.[H]/N=C(\N)N/C(N)=N/CCC1=CCC(C)=C1.[H]/N=C(\N)N/C(N)=N/CCC1=CCCC1C.[H]/N=C(\N)N/C(N)=N/CCC1=COCC1C.[H]/N=C(\N)N=C(N)N(C)CCC1=C(C)CC=C1.[H]/N=C(\N)N=C(N)N(C)CCC1=CCC(C)=C1.[H]/N=C(\N)N=C(N)N(C)CCC1=CCC=C1C
InChIInChI=1S/3C12H21N5.C11H19N5O.3C11H19N5.C10H17N5O.C10H17N5.C10H19N5.C10H17N5.C9H17N5O/c1-9-4-5-10(8-9)6-7-15-11(13)16-12(14)17(2)3;2*1-9-5-4-6-10(9)7-8-15-11(13)16-12(14)17(2)3;1-8-6-17-7-9(8)4-5-14-10(12)15-11(13)16(2)3;1-8-3-4-9(7-8)5-6-16(2)11(14)15-10(12)13;2*1-8-4-3-5-9(8)6-7-16(2)11(14)15-10(12)13;1-7-5-16-6-8(7)3-4-15(2)10(13)14-9(11)12;1-7-2-3-8(6-7)4-5-14-10(13)15-9(11)12;2*1-7-3-2-4-8(7)5-6-14-10(13)15-9(11)12;1-6-4-15-5-7(6)2-3-13-9(12)14-8(10)11/h5,8H,4,6-7H2,1-3H3,(H4,13,14,15,16);5-6H,4,7-8H2,1-3H3,(H4,13,14,15,16);4,6H,5,7-8H2,1-3H3,(H4,13,14,15,16);6-7H,4-5H2,1-3H3,(H4,12,13,14,15);4,7H,3,5-6H2,1-2H3,(H5,12,13,14,15);4-5H,3,6-7H2,1-2H3,(H5,12,13,14,15);3,5H,4,6-7H2,1-2H3,(H5,12,13,14,15);5-6H,3-4H2,1-2H3,(H5,11,12,13,14);3,6H,2,4-5H2,1H3,(H6,11,12,13,14,15);4,7H,2-3,5-6H2,1H3,(H6,11,12,13,14,15);2,4H,3,5-6H2,1H3,(H6,11,12,13,14,15);5-6H,2-4H2,1H3,(H6,10,11,12,13,14)
InChIKeyZCDFRXXZJKBKFI-UHFFFAOYSA-N
MW2665.64 g/mol
LogP7.29
Rot. Bonds36

About 1-carbamimidoyl-2-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(5-methylcyclopenten-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(3-methyl-2,3-dihydrofuran-4-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(5-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[2-(4-methylfuran-3-yl)ethyl]guanidine;1,1-dimethyl-3-[N'-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-3-[N'-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-3-[N'-[2-(5-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-2-[N'-[2-(4-methylfuran-3-yl)ethyl]carbamimidoyl]guanidine

1-carbamimidoyl-2-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(5-methylcyclopenten-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(3-methyl-2,3-dihydrofuran-4-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(5-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[2-(4-methylfuran-3-yl)ethyl]guanidine;1,1-dimethyl-3-[N'-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-3-[N'-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-3-[N'-[2-(5-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-2-[N'-[2-(4-methylfuran-3-yl)ethyl]carbamimidoyl]guanidine (PubChem CID 176541363) has the molecular formula C129H226N60O3 and a molecular weight of 2665.64 g/mol. Its IUPAC name is 1-carbamimidoyl-2-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(5-methylcyclopenten-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(3-methyl-2,3-dihydrofuran-4-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(5-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[2-(4-methylfuran-3-yl)ethyl]guanidine;1,1-dimethyl-3-[N'-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-3-[N'-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-3-[N'-[2-(5-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-2-[N'-[2-(4-methylfuran-3-yl)ethyl]carbamimidoyl]guanidine.

Molecular Properties

Compound Name1-carbamimidoyl-2-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(5-methylcyclopenten-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(3-methyl-2,3-dihydrofuran-4-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(5-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[2-(4-methylfuran-3-yl)ethyl]guanidine;1,1-dimethyl-3-[N'-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-3-[N'-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-3-[N'-[2-(5-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-2-[N'-[2-(4-methylfuran-3-yl)ethyl]carbamimidoyl]guanidine
PubChem CID176541363
Molecular FormulaC129H226N60O3
Molecular Weight2665.64 g/mol
Exact Mass2663.94
IUPAC Name1-carbamimidoyl-2-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(5-methylcyclopenten-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(3-methyl-2,3-dihydrofuran-4-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(5-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[2-(4-methylfuran-3-yl)ethyl]guanidine;1,1-dimethyl-3-[N'-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-3-[N'-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-3-[N'-[2-(5-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-2-[N'-[2-(4-methylfuran-3-yl)ethyl]carbamimidoyl]guanidine
SMILESCc1cocc1CC/N=C(\N)N=C(N)N(C)C.[H]/N=C(/N/C(N)=N/CCC1=C(C)CC=C1)N(C)C.[H]/N=C(/N/C(N)=N/CCC1=CCC(C)=C1)N(C)C.[H]/N=C(/N/C(N)=N/CCC1=CCC=C1C)N(C)C.[H]/N=C(/N=C(N)N)N(C)CCc1cocc1C.[H]/N=C(\N)N/C(N)=N/CCC1=C(C)CC=C1.[H]/N=C(\N)N/C(N)=N/CCC1=CCC(C)=C1.[H]/N=C(\N)N/C(N)=N/CCC1=CCCC1C.[H]/N=C(\N)N/C(N)=N/CCC1=COCC1C.[H]/N=C(\N)N=C(N)N(C)CCC1=C(C)CC=C1.[H]/N=C(\N)N=C(N)N(C)CCC1=CCC(C)=C1.[H]/N=C(\N)N=C(N)N(C)CCC1=CCC=C1C
InChIInChI=1S/3C12H21N5.C11H19N5O.3C11H19N5.C10H17N5O.C10H17N5.C10H19N5.C10H17N5.C9H17N5O/c1-9-4-5-10(8-9)6-7-15-11(13)16-12(14)17(2)3;2*1-9-5-4-6-10(9)7-8-15-11(13)16-12(14)17(2)3;1-8-6-17-7-9(8)4-5-14-10(12)15-11(13)16(2)3;1-8-3-4-9(7-8)5-6-16(2)11(14)15-10(12)13;2*1-8-4-3-5-9(8)6-7-16(2)11(14)15-10(12)13;1-7-5-16-6-8(7)3-4-15(2)10(13)14-9(11)12;1-7-2-3-8(6-7)4-5-14-10(13)15-9(11)12;2*1-7-3-2-4-8(7)5-6-14-10(13)15-9(11)12;1-6-4-15-5-7(6)2-3-13-9(12)14-8(10)11/h5,8H,4,6-7H2,1-3H3,(H4,13,14,15,16);5-6H,4,7-8H2,1-3H3,(H4,13,14,15,16);4,6H,5,7-8H2,1-3H3,(H4,13,14,15,16);6-7H,4-5H2,1-3H3,(H4,12,13,14,15);4,7H,3,5-6H2,1-2H3,(H5,12,13,14,15);4-5H,3,6-7H2,1-2H3,(H5,12,13,14,15);3,5H,4,6-7H2,1-2H3,(H5,12,13,14,15);5-6H,3-4H2,1-2H3,(H5,11,12,13,14);3,6H,2,4-5H2,1H3,(H6,11,12,13,14,15);4,7H,2-3,5-6H2,1H3,(H6,11,12,13,14,15);2,4H,3,5-6H2,1H3,(H6,11,12,13,14,15);5-6H,2-4H2,1H3,(H6,10,11,12,13,14)
InChIKeyZCDFRXXZJKBKFI-UHFFFAOYSA-N
XLogP7.29
TPSA1115.09 Ų
H-Bond Donors39
H-Bond Acceptors22
Rotatable Bonds36
Heavy Atoms192
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002665.64
LogP ≤ 57.29
H-Bond Donors ≤ 539
H-Bond Acceptors ≤ 1022

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 1-carbamimidoyl-2-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(5-methylcyclopenten-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(3-methyl-2,3-dihydrofuran-4-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(5-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[2-(4-methylfuran-3-yl)ethyl]guanidine;1,1-dimethyl-3-[N'-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-3-[N'-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-3-[N'-[2-(5-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-2-[N'-[2-(4-methylfuran-3-yl)ethyl]carbamimidoyl]guanidine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-carbamimidoyl-2-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(5-methylcyclopenten-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(3-methyl-2,3-dihydrofuran-4-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(5-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[2-(4-methylfuran-3-yl)ethyl]guanidine;1,1-dimethyl-3-[N'-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-3-[N'-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-3-[N'-[2-(5-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-2-[N'-[2-(4-methylfuran-3-yl)ethyl]carbamimidoyl]guanidine?
The IUPAC name of 1-carbamimidoyl-2-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(5-methylcyclopenten-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(3-methyl-2,3-dihydrofuran-4-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(5-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[2-(4-methylfuran-3-yl)ethyl]guanidine;1,1-dimethyl-3-[N'-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-3-[N'-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-3-[N'-[2-(5-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-2-[N'-[2-(4-methylfuran-3-yl)ethyl]carbamimidoyl]guanidine (CID 176541363) is 1-carbamimidoyl-2-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(5-methylcyclopenten-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(3-methyl-2,3-dihydrofuran-4-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(5-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[2-(4-methylfuran-3-yl)ethyl]guanidine;1,1-dimethyl-3-[N'-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-3-[N'-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-3-[N'-[2-(5-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-2-[N'-[2-(4-methylfuran-3-yl)ethyl]carbamimidoyl]guanidine.
What is the SMILES notation for 1-carbamimidoyl-2-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(5-methylcyclopenten-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(3-methyl-2,3-dihydrofuran-4-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(5-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[2-(4-methylfuran-3-yl)ethyl]guanidine;1,1-dimethyl-3-[N'-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-3-[N'-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-3-[N'-[2-(5-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-2-[N'-[2-(4-methylfuran-3-yl)ethyl]carbamimidoyl]guanidine?
The canonical SMILES for 1-carbamimidoyl-2-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(5-methylcyclopenten-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(3-methyl-2,3-dihydrofuran-4-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(5-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[2-(4-methylfuran-3-yl)ethyl]guanidine;1,1-dimethyl-3-[N'-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-3-[N'-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-3-[N'-[2-(5-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-2-[N'-[2-(4-methylfuran-3-yl)ethyl]carbamimidoyl]guanidine is Cc1cocc1CC/N=C(\N)N=C(N)N(C)C.[H]/N=C(/N/C(N)=N/CCC1=C(C)CC=C1)N(C)C.[H]/N=C(/N/C(N)=N/CCC1=CCC(C)=C1)N(C)C.[H]/N=C(/N/C(N)=N/CCC1=CCC=C1C)N(C)C.[H]/N=C(/N=C(N)N)N(C)CCc1cocc1C.[H]/N=C(\N)N/C(N)=N/CCC1=C(C)CC=C1.[H]/N=C(\N)N/C(N)=N/CCC1=CCC(C)=C1.[H]/N=C(\N)N/C(N)=N/CCC1=CCCC1C.[H]/N=C(\N)N/C(N)=N/CCC1=COCC1C.[H]/N=C(\N)N=C(N)N(C)CCC1=C(C)CC=C1.[H]/N=C(\N)N=C(N)N(C)CCC1=CCC(C)=C1.[H]/N=C(\N)N=C(N)N(C)CCC1=CCC=C1C.
What is the InChIKey of 1-carbamimidoyl-2-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(5-methylcyclopenten-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(3-methyl-2,3-dihydrofuran-4-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(5-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[2-(4-methylfuran-3-yl)ethyl]guanidine;1,1-dimethyl-3-[N'-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-3-[N'-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-3-[N'-[2-(5-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-2-[N'-[2-(4-methylfuran-3-yl)ethyl]carbamimidoyl]guanidine?
The InChIKey is ZCDFRXXZJKBKFI-UHFFFAOYSA-N. The full InChI is InChI=1S/3C12H21N5.C11H19N5O.3C11H19N5.C10H17N5O.C10H17N5.C10H19N5.C10H17N5.C9H17N5O/c1-9-4-5-10(8-9)6-7-15-11(13)16-12(14)17(2)3;2*1-9-5-4-6-10(9)7-8-15-11(13)16-12(14)17(2)3;1-8-6-17-7-9(8)4-5-14-10(12)15-11(13)16(2)3;1-8-3-4-9(7-8)5-6-16(2)11(14)15-10(12)13;2*1-8-4-3-5-9(8)6-7-16(2)11(14)15-10(12)13;1-7-5-16-6-8(7)3-4-15(2)10(13)14-9(11)12;1-7-2-3-8(6-7)4-5-14-10(13)15-9(11)12;2*1-7-3-2-4-8(7)5-6-14-10(13)15-9(11)12;1-6-4-15-5-7(6)2-3-13-9(12)14-8(10)11/h5,8H,4,6-7H2,1-3H3,(H4,13,14,15,16);5-6H,4,7-8H2,1-3H3,(H4,13,14,15,16);4,6H,5,7-8H2,1-3H3,(H4,13,14,15,16);6-7H,4-5H2,1-3H3,(H4,12,13,14,15);4,7H,3,5-6H2,1-2H3,(H5,12,13,14,15);4-5H,3,6-7H2,1-2H3,(H5,12,13,14,15);3,5H,4,6-7H2,1-2H3,(H5,12,13,14,15);5-6H,3-4H2,1-2H3,(H5,11,12,13,14);3,6H,2,4-5H2,1H3,(H6,11,12,13,14,15);4,7H,2-3,5-6H2,1H3,(H6,11,12,13,14,15);2,4H,3,5-6H2,1H3,(H6,11,12,13,14,15);5-6H,2-4H2,1H3,(H6,10,11,12,13,14).
What are the key properties of 1-carbamimidoyl-2-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(5-methylcyclopenten-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(3-methyl-2,3-dihydrofuran-4-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(5-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[2-(4-methylfuran-3-yl)ethyl]guanidine;1,1-dimethyl-3-[N'-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-3-[N'-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-3-[N'-[2-(5-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-2-[N'-[2-(4-methylfuran-3-yl)ethyl]carbamimidoyl]guanidine?
1-carbamimidoyl-2-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(5-methylcyclopenten-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(3-methyl-2,3-dihydrofuran-4-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(5-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[2-(4-methylfuran-3-yl)ethyl]guanidine;1,1-dimethyl-3-[N'-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-3-[N'-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-3-[N'-[2-(5-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-2-[N'-[2-(4-methylfuran-3-yl)ethyl]carbamimidoyl]guanidine has a molecular weight of 2665.64 g/mol, XLogP of 7.29, 36 rotatable bonds, 39 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for 1-carbamimidoyl-2-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(5-methylcyclopenten-1-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(3-methyl-2,3-dihydrofuran-4-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;2-carbamimidoyl-1-methyl-1-[2-(5-methylcyclopenta-1,4-dien-1-yl)ethyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[2-(4-methylfuran-3-yl)ethyl]guanidine;1,1-dimethyl-3-[N'-[2-(2-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-3-[N'-[2-(4-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-3-[N'-[2-(5-methylcyclopenta-1,4-dien-1-yl)ethyl]carbamimidoyl]guanidine;1,1-dimethyl-2-[N'-[2-(4-methylfuran-3-yl)ethyl]carbamimidoyl]guanidine is sourced from PubChem (CID 176541363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).