4-butyl-N-propan-2-ylpyrimidin-2-amine;6-chloro-2-(1,1-difluoroethyl)-N-propan-2-ylpyrimidin-4-amine;4-chloro-N,6-dimethyl-N-propan-2-ylpyrimidin-2-amine;N-[2-(dimethylamino)ethyl]-3-(propan-2-ylamino)pyrazine-2-carboxamide;2-[(dimethylamino)methyl]-N-propan-2-ylpyridin-3-amine;N,N-dimethyl-3-(propan-2-ylamino)pyrazine-2-carboxamide;ethyl 3-(propan-2-ylamino)pyridine-2-carboxylate;6-methoxy-N-propan-2-ylpyrazin-2-amine;2-(methylaminomethyl)-N-propan-2-ylpyridin-3-amine;N-methyl-3-(propan-2-ylamino)pyrazine-2-carboxamide;methyl 3-(propan-2-ylamino)pyridine-2-carboxylate;6-N-methyl-2-N-propan-2-ylpyrazine-2,6-diamine;4-methyl-N-propan-2-ylpyrimidin-2-amine;6-methylsulfanyl-N-propan-2-ylpyrazin-2-amine;3-(propan-2-ylamino)pyrazine-2-carboxamide;[3-(propan-2-ylamino)-2-pyridinyl]methanol

C151H241Cl2F2N51O10S — CID 161486246

IUPAC4-butyl-N-propan-2-ylpyrimidin-2-amine;6-chloro-2-(1,1-difluoroethyl)-N-propan-2-ylpyrimidin-4-amine;4-chloro-N,6-dimethyl-N-propan-2-ylpyrimidin-2-amine;N-[2-(dimethylamino)ethyl]-3-(propan-2-ylamino)pyrazine-2-carboxamide;2-[(dimethylamino)methyl]-N-propan-2-ylpyridin-3-amine;N,N-dimethyl-3-(propan-2-ylamino)pyrazine-2-carboxamide;ethyl 3-(propan-2-ylamino)pyridine-2-carboxylate;6-methoxy-N-propan-2-ylpyrazin-2-amine;2-(methylaminomethyl)-N-propan-2-ylpyridin-3-amine;N-methyl-3-(propan-2-ylamino)pyrazine-2-carboxamide;methyl 3-(propan-2-ylamino)pyridine-2-carboxylate;6-N-methyl-2-N-propan-2-ylpyrazine-2,6-diamine;4-methyl-N-propan-2-ylpyrimidin-2-amine;6-methylsulfanyl-N-propan-2-ylpyrazin-2-amine;3-(propan-2-ylamino)pyrazine-2-carboxamide;[3-(propan-2-ylamino)-2-pyridinyl]methanol
SMILESCC(C)Nc1cc(Cl)nc(C(C)(F)F)n1.CC(C)Nc1cccnc1CN(C)C.CC(C)Nc1cccnc1CO.CC(C)Nc1nccnc1C(=O)N(C)C.CC(C)Nc1nccnc1C(=O)NCCN(C)C.CC(C)Nc1nccnc1C(N)=O.CCCCc1ccnc(NC(C)C)n1.CCOC(=O)c1ncccc1NC(C)C.CNC(=O)c1nccnc1NC(C)C.CNCc1ncccc1NC(C)C.CNc1cncc(NC(C)C)n1.COC(=O)c1ncccc1NC(C)C.COc1cncc(NC(C)C)n1.CSc1cncc(NC(C)C)n1.Cc1cc(Cl)nc(N(C)C(C)C)n1.Cc1ccnc(NC(C)C)n1
InChIInChI=1S/C12H21N5O.2C11H19N3.C11H16N2O2.C10H16N4O.C10H17N3.C10H14N2O2.C9H12ClF2N3.C9H14ClN3.C9H14N4O.C9H14N2O.C8H12N4O.C8H14N4.C8H13N3O.C8H13N3S.C8H13N3/c1-9(2)16-11-10(13-5-6-14-11)12(18)15-7-8-17(3)4;1-9(2)13-10-6-5-7-12-11(10)8-14(3)4;1-4-5-6-10-7-8-12-11(14-10)13-9(2)3;1-4-15-11(14)10-9(13-8(2)3)6-5-7-12-10;1-7(2)13-9-8(10(15)14(3)4)11-5-6-12-9;1-8(2)13-9-5-4-6-12-10(9)7-11-3;1-7(2)12-8-5-4-6-11-9(8)10(13)14-3;1-5(2)13-7-4-6(10)14-8(15-7)9(3,11)12;1-6(2)13(4)9-11-7(3)5-8(10)12-9;1-6(2)13-8-7(9(14)10-3)11-4-5-12-8;1-7(2)11-8-4-3-5-10-9(8)6-12;1-5(2)12-8-6(7(9)13)10-3-4-11-8;1-6(2)11-8-5-10-4-7(9-3)12-8;2*1-6(2)10-7-4-9-5-8(11-7)12-3;1-6(2)10-8-9-5-4-7(3)11-8/h5-6,9H,7-8H2,1-4H3,(H,14,16)(H,15,18);5-7,9,13H,8H2,1-4H3;7-9H,4-6H2,1-3H3,(H,12,13,14);5-8,13H,4H2,1-3H3;5-7H,1-4H3,(H,12,13);4-6,8,11,13H,7H2,1-3H3;4-7,12H,1-3H3;4-5H,1-3H3,(H,13,14,15);5-6H,1-4H3;4-6H,1-3H3,(H,10,14)(H,12,13);3-5,7,11-12H,6H2,1-2H3;3-5H,1-2H3,(H2,9,13)(H,11,12);4-6H,1-3H3,(H2,9,11,12);2*4-6H,1-3H3,(H,10,11);4-6H,1-3H3,(H,9,10,11)
InChIKeyWEZYKAFTTMFJIT-UHFFFAOYSA-N
MW3071.90 g/mol
LogP25.64
Rot. Bonds54

About 4-butyl-N-propan-2-ylpyrimidin-2-amine;6-chloro-2-(1,1-difluoroethyl)-N-propan-2-ylpyrimidin-4-amine;4-chloro-N,6-dimethyl-N-propan-2-ylpyrimidin-2-amine;N-[2-(dimethylamino)ethyl]-3-(propan-2-ylamino)pyrazine-2-carboxamide;2-[(dimethylamino)methyl]-N-propan-2-ylpyridin-3-amine;N,N-dimethyl-3-(propan-2-ylamino)pyrazine-2-carboxamide;ethyl 3-(propan-2-ylamino)pyridine-2-carboxylate;6-methoxy-N-propan-2-ylpyrazin-2-amine;2-(methylaminomethyl)-N-propan-2-ylpyridin-3-amine;N-methyl-3-(propan-2-ylamino)pyrazine-2-carboxamide;methyl 3-(propan-2-ylamino)pyridine-2-carboxylate;6-N-methyl-2-N-propan-2-ylpyrazine-2,6-diamine;4-methyl-N-propan-2-ylpyrimidin-2-amine;6-methylsulfanyl-N-propan-2-ylpyrazin-2-amine;3-(propan-2-ylamino)pyrazine-2-carboxamide;[3-(propan-2-ylamino)-2-pyridinyl]methanol

4-butyl-N-propan-2-ylpyrimidin-2-amine;6-chloro-2-(1,1-difluoroethyl)-N-propan-2-ylpyrimidin-4-amine;4-chloro-N,6-dimethyl-N-propan-2-ylpyrimidin-2-amine;N-[2-(dimethylamino)ethyl]-3-(propan-2-ylamino)pyrazine-2-carboxamide;2-[(dimethylamino)methyl]-N-propan-2-ylpyridin-3-amine;N,N-dimethyl-3-(propan-2-ylamino)pyrazine-2-carboxamide;ethyl 3-(propan-2-ylamino)pyridine-2-carboxylate;6-methoxy-N-propan-2-ylpyrazin-2-amine;2-(methylaminomethyl)-N-propan-2-ylpyridin-3-amine;N-methyl-3-(propan-2-ylamino)pyrazine-2-carboxamide;methyl 3-(propan-2-ylamino)pyridine-2-carboxylate;6-N-methyl-2-N-propan-2-ylpyrazine-2,6-diamine;4-methyl-N-propan-2-ylpyrimidin-2-amine;6-methylsulfanyl-N-propan-2-ylpyrazin-2-amine;3-(propan-2-ylamino)pyrazine-2-carboxamide;[3-(propan-2-ylamino)-2-pyridinyl]methanol (PubChem CID 161486246) has the molecular formula C151H241Cl2F2N51O10S and a molecular weight of 3071.90 g/mol. Its IUPAC name is 4-butyl-N-propan-2-ylpyrimidin-2-amine;6-chloro-2-(1,1-difluoroethyl)-N-propan-2-ylpyrimidin-4-amine;4-chloro-N,6-dimethyl-N-propan-2-ylpyrimidin-2-amine;N-[2-(dimethylamino)ethyl]-3-(propan-2-ylamino)pyrazine-2-carboxamide;2-[(dimethylamino)methyl]-N-propan-2-ylpyridin-3-amine;N,N-dimethyl-3-(propan-2-ylamino)pyrazine-2-carboxamide;ethyl 3-(propan-2-ylamino)pyridine-2-carboxylate;6-methoxy-N-propan-2-ylpyrazin-2-amine;2-(methylaminomethyl)-N-propan-2-ylpyridin-3-amine;N-methyl-3-(propan-2-ylamino)pyrazine-2-carboxamide;methyl 3-(propan-2-ylamino)pyridine-2-carboxylate;6-N-methyl-2-N-propan-2-ylpyrazine-2,6-diamine;4-methyl-N-propan-2-ylpyrimidin-2-amine;6-methylsulfanyl-N-propan-2-ylpyrazin-2-amine;3-(propan-2-ylamino)pyrazine-2-carboxamide;[3-(propan-2-ylamino)-2-pyridinyl]methanol.

Molecular Properties

Compound Name4-butyl-N-propan-2-ylpyrimidin-2-amine;6-chloro-2-(1,1-difluoroethyl)-N-propan-2-ylpyrimidin-4-amine;4-chloro-N,6-dimethyl-N-propan-2-ylpyrimidin-2-amine;N-[2-(dimethylamino)ethyl]-3-(propan-2-ylamino)pyrazine-2-carboxamide;2-[(dimethylamino)methyl]-N-propan-2-ylpyridin-3-amine;N,N-dimethyl-3-(propan-2-ylamino)pyrazine-2-carboxamide;ethyl 3-(propan-2-ylamino)pyridine-2-carboxylate;6-methoxy-N-propan-2-ylpyrazin-2-amine;2-(methylaminomethyl)-N-propan-2-ylpyridin-3-amine;N-methyl-3-(propan-2-ylamino)pyrazine-2-carboxamide;methyl 3-(propan-2-ylamino)pyridine-2-carboxylate;6-N-methyl-2-N-propan-2-ylpyrazine-2,6-diamine;4-methyl-N-propan-2-ylpyrimidin-2-amine;6-methylsulfanyl-N-propan-2-ylpyrazin-2-amine;3-(propan-2-ylamino)pyrazine-2-carboxamide;[3-(propan-2-ylamino)-2-pyridinyl]methanol
PubChem CID161486246
Molecular FormulaC151H241Cl2F2N51O10S
Molecular Weight3071.90 g/mol
Exact Mass3068.90
IUPAC Name4-butyl-N-propan-2-ylpyrimidin-2-amine;6-chloro-2-(1,1-difluoroethyl)-N-propan-2-ylpyrimidin-4-amine;4-chloro-N,6-dimethyl-N-propan-2-ylpyrimidin-2-amine;N-[2-(dimethylamino)ethyl]-3-(propan-2-ylamino)pyrazine-2-carboxamide;2-[(dimethylamino)methyl]-N-propan-2-ylpyridin-3-amine;N,N-dimethyl-3-(propan-2-ylamino)pyrazine-2-carboxamide;ethyl 3-(propan-2-ylamino)pyridine-2-carboxylate;6-methoxy-N-propan-2-ylpyrazin-2-amine;2-(methylaminomethyl)-N-propan-2-ylpyridin-3-amine;N-methyl-3-(propan-2-ylamino)pyrazine-2-carboxamide;methyl 3-(propan-2-ylamino)pyridine-2-carboxylate;6-N-methyl-2-N-propan-2-ylpyrazine-2,6-diamine;4-methyl-N-propan-2-ylpyrimidin-2-amine;6-methylsulfanyl-N-propan-2-ylpyrazin-2-amine;3-(propan-2-ylamino)pyrazine-2-carboxamide;[3-(propan-2-ylamino)-2-pyridinyl]methanol
SMILESCC(C)Nc1cc(Cl)nc(C(C)(F)F)n1.CC(C)Nc1cccnc1CN(C)C.CC(C)Nc1cccnc1CO.CC(C)Nc1nccnc1C(=O)N(C)C.CC(C)Nc1nccnc1C(=O)NCCN(C)C.CC(C)Nc1nccnc1C(N)=O.CCCCc1ccnc(NC(C)C)n1.CCOC(=O)c1ncccc1NC(C)C.CNC(=O)c1nccnc1NC(C)C.CNCc1ncccc1NC(C)C.CNc1cncc(NC(C)C)n1.COC(=O)c1ncccc1NC(C)C.COc1cncc(NC(C)C)n1.CSc1cncc(NC(C)C)n1.Cc1cc(Cl)nc(N(C)C(C)C)n1.Cc1ccnc(NC(C)C)n1
InChIInChI=1S/C12H21N5O.2C11H19N3.C11H16N2O2.C10H16N4O.C10H17N3.C10H14N2O2.C9H12ClF2N3.C9H14ClN3.C9H14N4O.C9H14N2O.C8H12N4O.C8H14N4.C8H13N3O.C8H13N3S.C8H13N3/c1-9(2)16-11-10(13-5-6-14-11)12(18)15-7-8-17(3)4;1-9(2)13-10-6-5-7-12-11(10)8-14(3)4;1-4-5-6-10-7-8-12-11(14-10)13-9(2)3;1-4-15-11(14)10-9(13-8(2)3)6-5-7-12-10;1-7(2)13-9-8(10(15)14(3)4)11-5-6-12-9;1-8(2)13-9-5-4-6-12-10(9)7-11-3;1-7(2)12-8-5-4-6-11-9(8)10(13)14-3;1-5(2)13-7-4-6(10)14-8(15-7)9(3,11)12;1-6(2)13(4)9-11-7(3)5-8(10)12-9;1-6(2)13-8-7(9(14)10-3)11-4-5-12-8;1-7(2)11-8-4-3-5-10-9(8)6-12;1-5(2)12-8-6(7(9)13)10-3-4-11-8;1-6(2)11-8-5-10-4-7(9-3)12-8;2*1-6(2)10-7-4-9-5-8(11-7)12-3;1-6(2)10-8-9-5-4-7(3)11-8/h5-6,9H,7-8H2,1-4H3,(H,14,16)(H,15,18);5-7,9,13H,8H2,1-4H3;7-9H,4-6H2,1-3H3,(H,12,13,14);5-8,13H,4H2,1-3H3;5-7H,1-4H3,(H,12,13);4-6,8,11,13H,7H2,1-3H3;4-7,12H,1-3H3;4-5H,1-3H3,(H,13,14,15);5-6H,1-4H3;4-6H,1-3H3,(H,10,14)(H,12,13);3-5,7,11-12H,6H2,1-2H3;3-5H,1-2H3,(H2,9,13)(H,11,12);4-6H,1-3H3,(H2,9,11,12);2*4-6H,1-3H3,(H,10,11);4-6H,1-3H3,(H,9,10,11)
InChIKeyWEZYKAFTTMFJIT-UHFFFAOYSA-N
XLogP25.64
TPSA765.92 Ų
H-Bond Donors21
H-Bond Acceptors58
Rotatable Bonds54
Heavy Atoms217
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003071.90
LogP ≤ 525.64
H-Bond Donors ≤ 521
H-Bond Acceptors ≤ 1058

Analyze 4-butyl-N-propan-2-ylpyrimidin-2-amine;6-chloro-2-(1,1-difluoroethyl)-N-propan-2-ylpyrimidin-4-amine;4-chloro-N,6-dimethyl-N-propan-2-ylpyrimidin-2-amine;N-[2-(dimethylamino)ethyl]-3-(propan-2-ylamino)pyrazine-2-carboxamide;2-[(dimethylamino)methyl]-N-propan-2-ylpyridin-3-amine;N,N-dimethyl-3-(propan-2-ylamino)pyrazine-2-carboxamide;ethyl 3-(propan-2-ylamino)pyridine-2-carboxylate;6-methoxy-N-propan-2-ylpyrazin-2-amine;2-(methylaminomethyl)-N-propan-2-ylpyridin-3-amine;N-methyl-3-(propan-2-ylamino)pyrazine-2-carboxamide;methyl 3-(propan-2-ylamino)pyridine-2-carboxylate;6-N-methyl-2-N-propan-2-ylpyrazine-2,6-diamine;4-methyl-N-propan-2-ylpyrimidin-2-amine;6-methylsulfanyl-N-propan-2-ylpyrazin-2-amine;3-(propan-2-ylamino)pyrazine-2-carboxamide;[3-(propan-2-ylamino)-2-pyridinyl]methanol with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-butyl-N-propan-2-ylpyrimidin-2-amine;6-chloro-2-(1,1-difluoroethyl)-N-propan-2-ylpyrimidin-4-amine;4-chloro-N,6-dimethyl-N-propan-2-ylpyrimidin-2-amine;N-[2-(dimethylamino)ethyl]-3-(propan-2-ylamino)pyrazine-2-carboxamide;2-[(dimethylamino)methyl]-N-propan-2-ylpyridin-3-amine;N,N-dimethyl-3-(propan-2-ylamino)pyrazine-2-carboxamide;ethyl 3-(propan-2-ylamino)pyridine-2-carboxylate;6-methoxy-N-propan-2-ylpyrazin-2-amine;2-(methylaminomethyl)-N-propan-2-ylpyridin-3-amine;N-methyl-3-(propan-2-ylamino)pyrazine-2-carboxamide;methyl 3-(propan-2-ylamino)pyridine-2-carboxylate;6-N-methyl-2-N-propan-2-ylpyrazine-2,6-diamine;4-methyl-N-propan-2-ylpyrimidin-2-amine;6-methylsulfanyl-N-propan-2-ylpyrazin-2-amine;3-(propan-2-ylamino)pyrazine-2-carboxamide;[3-(propan-2-ylamino)-2-pyridinyl]methanol?
The IUPAC name of 4-butyl-N-propan-2-ylpyrimidin-2-amine;6-chloro-2-(1,1-difluoroethyl)-N-propan-2-ylpyrimidin-4-amine;4-chloro-N,6-dimethyl-N-propan-2-ylpyrimidin-2-amine;N-[2-(dimethylamino)ethyl]-3-(propan-2-ylamino)pyrazine-2-carboxamide;2-[(dimethylamino)methyl]-N-propan-2-ylpyridin-3-amine;N,N-dimethyl-3-(propan-2-ylamino)pyrazine-2-carboxamide;ethyl 3-(propan-2-ylamino)pyridine-2-carboxylate;6-methoxy-N-propan-2-ylpyrazin-2-amine;2-(methylaminomethyl)-N-propan-2-ylpyridin-3-amine;N-methyl-3-(propan-2-ylamino)pyrazine-2-carboxamide;methyl 3-(propan-2-ylamino)pyridine-2-carboxylate;6-N-methyl-2-N-propan-2-ylpyrazine-2,6-diamine;4-methyl-N-propan-2-ylpyrimidin-2-amine;6-methylsulfanyl-N-propan-2-ylpyrazin-2-amine;3-(propan-2-ylamino)pyrazine-2-carboxamide;[3-(propan-2-ylamino)-2-pyridinyl]methanol (CID 161486246) is 4-butyl-N-propan-2-ylpyrimidin-2-amine;6-chloro-2-(1,1-difluoroethyl)-N-propan-2-ylpyrimidin-4-amine;4-chloro-N,6-dimethyl-N-propan-2-ylpyrimidin-2-amine;N-[2-(dimethylamino)ethyl]-3-(propan-2-ylamino)pyrazine-2-carboxamide;2-[(dimethylamino)methyl]-N-propan-2-ylpyridin-3-amine;N,N-dimethyl-3-(propan-2-ylamino)pyrazine-2-carboxamide;ethyl 3-(propan-2-ylamino)pyridine-2-carboxylate;6-methoxy-N-propan-2-ylpyrazin-2-amine;2-(methylaminomethyl)-N-propan-2-ylpyridin-3-amine;N-methyl-3-(propan-2-ylamino)pyrazine-2-carboxamide;methyl 3-(propan-2-ylamino)pyridine-2-carboxylate;6-N-methyl-2-N-propan-2-ylpyrazine-2,6-diamine;4-methyl-N-propan-2-ylpyrimidin-2-amine;6-methylsulfanyl-N-propan-2-ylpyrazin-2-amine;3-(propan-2-ylamino)pyrazine-2-carboxamide;[3-(propan-2-ylamino)-2-pyridinyl]methanol.
What is the SMILES notation for 4-butyl-N-propan-2-ylpyrimidin-2-amine;6-chloro-2-(1,1-difluoroethyl)-N-propan-2-ylpyrimidin-4-amine;4-chloro-N,6-dimethyl-N-propan-2-ylpyrimidin-2-amine;N-[2-(dimethylamino)ethyl]-3-(propan-2-ylamino)pyrazine-2-carboxamide;2-[(dimethylamino)methyl]-N-propan-2-ylpyridin-3-amine;N,N-dimethyl-3-(propan-2-ylamino)pyrazine-2-carboxamide;ethyl 3-(propan-2-ylamino)pyridine-2-carboxylate;6-methoxy-N-propan-2-ylpyrazin-2-amine;2-(methylaminomethyl)-N-propan-2-ylpyridin-3-amine;N-methyl-3-(propan-2-ylamino)pyrazine-2-carboxamide;methyl 3-(propan-2-ylamino)pyridine-2-carboxylate;6-N-methyl-2-N-propan-2-ylpyrazine-2,6-diamine;4-methyl-N-propan-2-ylpyrimidin-2-amine;6-methylsulfanyl-N-propan-2-ylpyrazin-2-amine;3-(propan-2-ylamino)pyrazine-2-carboxamide;[3-(propan-2-ylamino)-2-pyridinyl]methanol?
The canonical SMILES for 4-butyl-N-propan-2-ylpyrimidin-2-amine;6-chloro-2-(1,1-difluoroethyl)-N-propan-2-ylpyrimidin-4-amine;4-chloro-N,6-dimethyl-N-propan-2-ylpyrimidin-2-amine;N-[2-(dimethylamino)ethyl]-3-(propan-2-ylamino)pyrazine-2-carboxamide;2-[(dimethylamino)methyl]-N-propan-2-ylpyridin-3-amine;N,N-dimethyl-3-(propan-2-ylamino)pyrazine-2-carboxamide;ethyl 3-(propan-2-ylamino)pyridine-2-carboxylate;6-methoxy-N-propan-2-ylpyrazin-2-amine;2-(methylaminomethyl)-N-propan-2-ylpyridin-3-amine;N-methyl-3-(propan-2-ylamino)pyrazine-2-carboxamide;methyl 3-(propan-2-ylamino)pyridine-2-carboxylate;6-N-methyl-2-N-propan-2-ylpyrazine-2,6-diamine;4-methyl-N-propan-2-ylpyrimidin-2-amine;6-methylsulfanyl-N-propan-2-ylpyrazin-2-amine;3-(propan-2-ylamino)pyrazine-2-carboxamide;[3-(propan-2-ylamino)-2-pyridinyl]methanol is CC(C)Nc1cc(Cl)nc(C(C)(F)F)n1.CC(C)Nc1cccnc1CN(C)C.CC(C)Nc1cccnc1CO.CC(C)Nc1nccnc1C(=O)N(C)C.CC(C)Nc1nccnc1C(=O)NCCN(C)C.CC(C)Nc1nccnc1C(N)=O.CCCCc1ccnc(NC(C)C)n1.CCOC(=O)c1ncccc1NC(C)C.CNC(=O)c1nccnc1NC(C)C.CNCc1ncccc1NC(C)C.CNc1cncc(NC(C)C)n1.COC(=O)c1ncccc1NC(C)C.COc1cncc(NC(C)C)n1.CSc1cncc(NC(C)C)n1.Cc1cc(Cl)nc(N(C)C(C)C)n1.Cc1ccnc(NC(C)C)n1.
What is the InChIKey of 4-butyl-N-propan-2-ylpyrimidin-2-amine;6-chloro-2-(1,1-difluoroethyl)-N-propan-2-ylpyrimidin-4-amine;4-chloro-N,6-dimethyl-N-propan-2-ylpyrimidin-2-amine;N-[2-(dimethylamino)ethyl]-3-(propan-2-ylamino)pyrazine-2-carboxamide;2-[(dimethylamino)methyl]-N-propan-2-ylpyridin-3-amine;N,N-dimethyl-3-(propan-2-ylamino)pyrazine-2-carboxamide;ethyl 3-(propan-2-ylamino)pyridine-2-carboxylate;6-methoxy-N-propan-2-ylpyrazin-2-amine;2-(methylaminomethyl)-N-propan-2-ylpyridin-3-amine;N-methyl-3-(propan-2-ylamino)pyrazine-2-carboxamide;methyl 3-(propan-2-ylamino)pyridine-2-carboxylate;6-N-methyl-2-N-propan-2-ylpyrazine-2,6-diamine;4-methyl-N-propan-2-ylpyrimidin-2-amine;6-methylsulfanyl-N-propan-2-ylpyrazin-2-amine;3-(propan-2-ylamino)pyrazine-2-carboxamide;[3-(propan-2-ylamino)-2-pyridinyl]methanol?
The InChIKey is WEZYKAFTTMFJIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N5O.2C11H19N3.C11H16N2O2.C10H16N4O.C10H17N3.C10H14N2O2.C9H12ClF2N3.C9H14ClN3.C9H14N4O.C9H14N2O.C8H12N4O.C8H14N4.C8H13N3O.C8H13N3S.C8H13N3/c1-9(2)16-11-10(13-5-6-14-11)12(18)15-7-8-17(3)4;1-9(2)13-10-6-5-7-12-11(10)8-14(3)4;1-4-5-6-10-7-8-12-11(14-10)13-9(2)3;1-4-15-11(14)10-9(13-8(2)3)6-5-7-12-10;1-7(2)13-9-8(10(15)14(3)4)11-5-6-12-9;1-8(2)13-9-5-4-6-12-10(9)7-11-3;1-7(2)12-8-5-4-6-11-9(8)10(13)14-3;1-5(2)13-7-4-6(10)14-8(15-7)9(3,11)12;1-6(2)13(4)9-11-7(3)5-8(10)12-9;1-6(2)13-8-7(9(14)10-3)11-4-5-12-8;1-7(2)11-8-4-3-5-10-9(8)6-12;1-5(2)12-8-6(7(9)13)10-3-4-11-8;1-6(2)11-8-5-10-4-7(9-3)12-8;2*1-6(2)10-7-4-9-5-8(11-7)12-3;1-6(2)10-8-9-5-4-7(3)11-8/h5-6,9H,7-8H2,1-4H3,(H,14,16)(H,15,18);5-7,9,13H,8H2,1-4H3;7-9H,4-6H2,1-3H3,(H,12,13,14);5-8,13H,4H2,1-3H3;5-7H,1-4H3,(H,12,13);4-6,8,11,13H,7H2,1-3H3;4-7,12H,1-3H3;4-5H,1-3H3,(H,13,14,15);5-6H,1-4H3;4-6H,1-3H3,(H,10,14)(H,12,13);3-5,7,11-12H,6H2,1-2H3;3-5H,1-2H3,(H2,9,13)(H,11,12);4-6H,1-3H3,(H2,9,11,12);2*4-6H,1-3H3,(H,10,11);4-6H,1-3H3,(H,9,10,11).
What are the key properties of 4-butyl-N-propan-2-ylpyrimidin-2-amine;6-chloro-2-(1,1-difluoroethyl)-N-propan-2-ylpyrimidin-4-amine;4-chloro-N,6-dimethyl-N-propan-2-ylpyrimidin-2-amine;N-[2-(dimethylamino)ethyl]-3-(propan-2-ylamino)pyrazine-2-carboxamide;2-[(dimethylamino)methyl]-N-propan-2-ylpyridin-3-amine;N,N-dimethyl-3-(propan-2-ylamino)pyrazine-2-carboxamide;ethyl 3-(propan-2-ylamino)pyridine-2-carboxylate;6-methoxy-N-propan-2-ylpyrazin-2-amine;2-(methylaminomethyl)-N-propan-2-ylpyridin-3-amine;N-methyl-3-(propan-2-ylamino)pyrazine-2-carboxamide;methyl 3-(propan-2-ylamino)pyridine-2-carboxylate;6-N-methyl-2-N-propan-2-ylpyrazine-2,6-diamine;4-methyl-N-propan-2-ylpyrimidin-2-amine;6-methylsulfanyl-N-propan-2-ylpyrazin-2-amine;3-(propan-2-ylamino)pyrazine-2-carboxamide;[3-(propan-2-ylamino)-2-pyridinyl]methanol?
4-butyl-N-propan-2-ylpyrimidin-2-amine;6-chloro-2-(1,1-difluoroethyl)-N-propan-2-ylpyrimidin-4-amine;4-chloro-N,6-dimethyl-N-propan-2-ylpyrimidin-2-amine;N-[2-(dimethylamino)ethyl]-3-(propan-2-ylamino)pyrazine-2-carboxamide;2-[(dimethylamino)methyl]-N-propan-2-ylpyridin-3-amine;N,N-dimethyl-3-(propan-2-ylamino)pyrazine-2-carboxamide;ethyl 3-(propan-2-ylamino)pyridine-2-carboxylate;6-methoxy-N-propan-2-ylpyrazin-2-amine;2-(methylaminomethyl)-N-propan-2-ylpyridin-3-amine;N-methyl-3-(propan-2-ylamino)pyrazine-2-carboxamide;methyl 3-(propan-2-ylamino)pyridine-2-carboxylate;6-N-methyl-2-N-propan-2-ylpyrazine-2,6-diamine;4-methyl-N-propan-2-ylpyrimidin-2-amine;6-methylsulfanyl-N-propan-2-ylpyrazin-2-amine;3-(propan-2-ylamino)pyrazine-2-carboxamide;[3-(propan-2-ylamino)-2-pyridinyl]methanol has a molecular weight of 3071.90 g/mol, XLogP of 25.64, 54 rotatable bonds, 21 hydrogen bond donors, and 58 hydrogen bond acceptors.
Where does this data come from?
All data for 4-butyl-N-propan-2-ylpyrimidin-2-amine;6-chloro-2-(1,1-difluoroethyl)-N-propan-2-ylpyrimidin-4-amine;4-chloro-N,6-dimethyl-N-propan-2-ylpyrimidin-2-amine;N-[2-(dimethylamino)ethyl]-3-(propan-2-ylamino)pyrazine-2-carboxamide;2-[(dimethylamino)methyl]-N-propan-2-ylpyridin-3-amine;N,N-dimethyl-3-(propan-2-ylamino)pyrazine-2-carboxamide;ethyl 3-(propan-2-ylamino)pyridine-2-carboxylate;6-methoxy-N-propan-2-ylpyrazin-2-amine;2-(methylaminomethyl)-N-propan-2-ylpyridin-3-amine;N-methyl-3-(propan-2-ylamino)pyrazine-2-carboxamide;methyl 3-(propan-2-ylamino)pyridine-2-carboxylate;6-N-methyl-2-N-propan-2-ylpyrazine-2,6-diamine;4-methyl-N-propan-2-ylpyrimidin-2-amine;6-methylsulfanyl-N-propan-2-ylpyrazin-2-amine;3-(propan-2-ylamino)pyrazine-2-carboxamide;[3-(propan-2-ylamino)-2-pyridinyl]methanol is sourced from PubChem (CID 161486246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).