3-tert-butyl-2,5-dimethylfuran;4-tert-butyl-3,5-dimethyl-1,2-oxazole;4-tert-butyl-3,5-dimethyl-1H-pyrazole;5-tert-butyl-3-fluoropyridin-2-amine;3-tert-butylfuran;5-tert-butyl-1H-indole;bis(4-tert-butyl-5-methyl-1H-pyrazole);4-tert-butyl-1H-pyrazole;5-tert-butyl-1H-pyrazole;4-tert-butylpyridin-2-amine;5-tert-butylpyridin-2-amine;5-tert-butylpyrimidin-2-amine;3-tert-butyl-1H-pyrrolo[2,3-b]pyridine;5-tert-butyl-1H-pyrrolo[2,3-b]pyridine

C135H208FN25O3 — CID 161065488

IUPAC3-tert-butyl-2,5-dimethylfuran;4-tert-butyl-3,5-dimethyl-1,2-oxazole;4-tert-butyl-3,5-dimethyl-1H-pyrazole;5-tert-butyl-3-fluoropyridin-2-amine;3-tert-butylfuran;5-tert-butyl-1H-indole;bis(4-tert-butyl-5-methyl-1H-pyrazole);4-tert-butyl-1H-pyrazole;5-tert-butyl-1H-pyrazole;4-tert-butylpyridin-2-amine;5-tert-butylpyridin-2-amine;5-tert-butylpyrimidin-2-amine;3-tert-butyl-1H-pyrrolo[2,3-b]pyridine;5-tert-butyl-1H-pyrrolo[2,3-b]pyridine
SMILESCC(C)(C)c1c[nH]c2ncccc12.CC(C)(C)c1ccc(N)nc1.CC(C)(C)c1ccc2[nH]ccc2c1.CC(C)(C)c1ccn[nH]1.CC(C)(C)c1ccnc(N)c1.CC(C)(C)c1ccoc1.CC(C)(C)c1cn[nH]c1.CC(C)(C)c1cnc(N)c(F)c1.CC(C)(C)c1cnc(N)nc1.CC(C)(C)c1cnc2[nH]ccc2c1.Cc1[nH]ncc1C(C)(C)C.Cc1[nH]ncc1C(C)(C)C.Cc1cc(C(C)(C)C)c(C)o1.Cc1n[nH]c(C)c1C(C)(C)C.Cc1noc(C)c1C(C)(C)C
InChIInChI=1S/C12H15N.2C11H14N2.C10H16O.C9H13FN2.C9H16N2.2C9H14N2.C9H15NO.C8H13N3.2C8H14N2.C8H12O.2C7H12N2/c1-12(2,3)10-4-5-11-9(8-10)6-7-13-11;1-11(2,3)9-6-8-4-5-12-10(8)13-7-9;1-11(2,3)9-7-13-10-8(9)5-4-6-12-10;1-7-6-9(8(2)11-7)10(3,4)5;1-9(2,3)6-4-7(10)8(11)12-5-6;1-6-8(9(3,4)5)7(2)11-10-6;1-9(2,3)7-4-5-11-8(10)6-7;1-9(2,3)7-4-5-8(10)11-6-7;1-6-8(9(3,4)5)7(2)11-10-6;1-8(2,3)6-4-10-7(9)11-5-6;2*1-6-7(5-9-10-6)8(2,3)4;1-8(2,3)7-4-5-9-6-7;1-7(2,3)6-4-8-9-5-6;1-7(2,3)6-4-5-8-9-6/h4-8,13H,1-3H3;2*4-7H,1-3H3,(H,12,13);6H,1-5H3;4-5H,1-3H3,(H2,11,12);1-5H3,(H,10,11);2*4-6H,1-3H3,(H2,10,11);1-5H3;4-5H,1-3H3,(H2,9,10,11);2*5H,1-4H3,(H,9,10);4-6H,1-3H3;2*4-5H,1-3H3,(H,8,9)
InChIKeyUDYVDZXCIRAPMM-UHFFFAOYSA-N
MW2248.32 g/mol
LogP34.70
Rot. Bonds

About 3-tert-butyl-2,5-dimethylfuran;4-tert-butyl-3,5-dimethyl-1,2-oxazole;4-tert-butyl-3,5-dimethyl-1H-pyrazole;5-tert-butyl-3-fluoropyridin-2-amine;3-tert-butylfuran;5-tert-butyl-1H-indole;bis(4-tert-butyl-5-methyl-1H-pyrazole);4-tert-butyl-1H-pyrazole;5-tert-butyl-1H-pyrazole;4-tert-butylpyridin-2-amine;5-tert-butylpyridin-2-amine;5-tert-butylpyrimidin-2-amine;3-tert-butyl-1H-pyrrolo[2,3-b]pyridine;5-tert-butyl-1H-pyrrolo[2,3-b]pyridine

3-tert-butyl-2,5-dimethylfuran;4-tert-butyl-3,5-dimethyl-1,2-oxazole;4-tert-butyl-3,5-dimethyl-1H-pyrazole;5-tert-butyl-3-fluoropyridin-2-amine;3-tert-butylfuran;5-tert-butyl-1H-indole;bis(4-tert-butyl-5-methyl-1H-pyrazole);4-tert-butyl-1H-pyrazole;5-tert-butyl-1H-pyrazole;4-tert-butylpyridin-2-amine;5-tert-butylpyridin-2-amine;5-tert-butylpyrimidin-2-amine;3-tert-butyl-1H-pyrrolo[2,3-b]pyridine;5-tert-butyl-1H-pyrrolo[2,3-b]pyridine (PubChem CID 161065488) has the molecular formula C135H208FN25O3 and a molecular weight of 2248.32 g/mol. Its IUPAC name is 3-tert-butyl-2,5-dimethylfuran;4-tert-butyl-3,5-dimethyl-1,2-oxazole;4-tert-butyl-3,5-dimethyl-1H-pyrazole;5-tert-butyl-3-fluoropyridin-2-amine;3-tert-butylfuran;5-tert-butyl-1H-indole;bis(4-tert-butyl-5-methyl-1H-pyrazole);4-tert-butyl-1H-pyrazole;5-tert-butyl-1H-pyrazole;4-tert-butylpyridin-2-amine;5-tert-butylpyridin-2-amine;5-tert-butylpyrimidin-2-amine;3-tert-butyl-1H-pyrrolo[2,3-b]pyridine;5-tert-butyl-1H-pyrrolo[2,3-b]pyridine.

Molecular Properties

Compound Name3-tert-butyl-2,5-dimethylfuran;4-tert-butyl-3,5-dimethyl-1,2-oxazole;4-tert-butyl-3,5-dimethyl-1H-pyrazole;5-tert-butyl-3-fluoropyridin-2-amine;3-tert-butylfuran;5-tert-butyl-1H-indole;bis(4-tert-butyl-5-methyl-1H-pyrazole);4-tert-butyl-1H-pyrazole;5-tert-butyl-1H-pyrazole;4-tert-butylpyridin-2-amine;5-tert-butylpyridin-2-amine;5-tert-butylpyrimidin-2-amine;3-tert-butyl-1H-pyrrolo[2,3-b]pyridine;5-tert-butyl-1H-pyrrolo[2,3-b]pyridine
PubChem CID161065488
Molecular FormulaC135H208FN25O3
Molecular Weight2248.32 g/mol
Exact Mass2246.69
IUPAC Name3-tert-butyl-2,5-dimethylfuran;4-tert-butyl-3,5-dimethyl-1,2-oxazole;4-tert-butyl-3,5-dimethyl-1H-pyrazole;5-tert-butyl-3-fluoropyridin-2-amine;3-tert-butylfuran;5-tert-butyl-1H-indole;bis(4-tert-butyl-5-methyl-1H-pyrazole);4-tert-butyl-1H-pyrazole;5-tert-butyl-1H-pyrazole;4-tert-butylpyridin-2-amine;5-tert-butylpyridin-2-amine;5-tert-butylpyrimidin-2-amine;3-tert-butyl-1H-pyrrolo[2,3-b]pyridine;5-tert-butyl-1H-pyrrolo[2,3-b]pyridine
SMILESCC(C)(C)c1c[nH]c2ncccc12.CC(C)(C)c1ccc(N)nc1.CC(C)(C)c1ccc2[nH]ccc2c1.CC(C)(C)c1ccn[nH]1.CC(C)(C)c1ccnc(N)c1.CC(C)(C)c1ccoc1.CC(C)(C)c1cn[nH]c1.CC(C)(C)c1cnc(N)c(F)c1.CC(C)(C)c1cnc(N)nc1.CC(C)(C)c1cnc2[nH]ccc2c1.Cc1[nH]ncc1C(C)(C)C.Cc1[nH]ncc1C(C)(C)C.Cc1cc(C(C)(C)C)c(C)o1.Cc1n[nH]c(C)c1C(C)(C)C.Cc1noc(C)c1C(C)(C)C
InChIInChI=1S/C12H15N.2C11H14N2.C10H16O.C9H13FN2.C9H16N2.2C9H14N2.C9H15NO.C8H13N3.2C8H14N2.C8H12O.2C7H12N2/c1-12(2,3)10-4-5-11-9(8-10)6-7-13-11;1-11(2,3)9-6-8-4-5-12-10(8)13-7-9;1-11(2,3)9-7-13-10-8(9)5-4-6-12-10;1-7-6-9(8(2)11-7)10(3,4)5;1-9(2,3)6-4-7(10)8(11)12-5-6;1-6-8(9(3,4)5)7(2)11-10-6;1-9(2,3)7-4-5-11-8(10)6-7;1-9(2,3)7-4-5-8(10)11-6-7;1-6-8(9(3,4)5)7(2)11-10-6;1-8(2,3)6-4-10-7(9)11-5-6;2*1-6-7(5-9-10-6)8(2,3)4;1-8(2,3)7-4-5-9-6-7;1-7(2,3)6-4-8-9-5-6;1-7(2,3)6-4-5-8-9-6/h4-8,13H,1-3H3;2*4-7H,1-3H3,(H,12,13);6H,1-5H3;4-5H,1-3H3,(H2,11,12);1-5H3,(H,10,11);2*4-6H,1-3H3,(H2,10,11);1-5H3;4-5H,1-3H3,(H2,9,10,11);2*5H,1-4H3,(H,9,10);4-6H,1-3H3;2*4-5H,1-3H3,(H,8,9)
InChIKeyUDYVDZXCIRAPMM-UHFFFAOYSA-N
XLogP34.70
TPSA437.39 Ų
H-Bond Donors12
H-Bond Acceptors20
Rotatable Bonds
Heavy Atoms164
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002248.32
LogP ≤ 534.70
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1020

Analyze 3-tert-butyl-2,5-dimethylfuran;4-tert-butyl-3,5-dimethyl-1,2-oxazole;4-tert-butyl-3,5-dimethyl-1H-pyrazole;5-tert-butyl-3-fluoropyridin-2-amine;3-tert-butylfuran;5-tert-butyl-1H-indole;bis(4-tert-butyl-5-methyl-1H-pyrazole);4-tert-butyl-1H-pyrazole;5-tert-butyl-1H-pyrazole;4-tert-butylpyridin-2-amine;5-tert-butylpyridin-2-amine;5-tert-butylpyrimidin-2-amine;3-tert-butyl-1H-pyrrolo[2,3-b]pyridine;5-tert-butyl-1H-pyrrolo[2,3-b]pyridine with MolForge

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Launch Full Analysis

Related Compounds

N-[5-[4-fluoro-7-[4-[2-[4-fluoro-5-(4-methyl-3-pyridinyl)-1H-indazol-3-yl]-1H-imidazo[4,5-c]pyridin-4-yl]furan-3-yl]-3-[4-(furan-3-yl)-1H-imidazo[4,5-c]pyridin-2-yl]-1H-indazol-5-yl]-3-pyridinyl]-3-methylbutanamide
CID 145034593
N-[5-[7-fluoro-8-[4-[2-[6-fluoro-1-methyl-5-[5-(pyrrolidin-1-ylmethyl)-3-pyridinyl]indazol-3-yl]-3,4-dihydroimidazo[4,5-b]azepin-8-yl]furan-2-yl]-4-[7-(furan-3-yl)-3H-imidazo[4,5-b]pyridin-2-yl]-1,2-dihydrocinnolin-6-yl]-3-pyridinyl]benzamide
CID 145037079
N-[3-(1,1-difluoroethyl)-1-benzofuran-6-yl]-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine;N-[3-(1,1-difluoroethyl)-1-benzofuran-6-yl]-2H-pyrazolo[3,4-b]pyrazin-3-amine;3-(3,3-dimethylbutyl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)-1,2-benzoxazol-6-amine;3-pentan-3-yl-N-(2H-pyrazolo[3,4-b]pyrazin-3-yl)-1,2-benzoxazol-6-amine;3-pentan-3-yl-N-(2H-pyrazolo[3,4-b]pyridin-3-yl)-1,2-benzoxazol-6-amine
CID 161331815
3-(diethylaminomethyl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)-1,2-benzoxazol-6-amine;N-[3-(1,1-difluoroethyl)-1-benzofuran-6-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[3-(1,1-difluoroethyl)-1-benzofuran-6-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine;3-ethyl-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)-1,2-benzoxazol-6-amine;N-(1H-pyrazolo[4,3-b]pyridin-3-yl)-3-(pyrazol-1-ylmethyl)-1,2-benzoxazol-6-amine
CID 161751314
3-(cyclohexylmethyl)-N-(2H-pyrazolo[3,4-b]pyrazin-3-yl)-1,2-benzoxazol-6-amine;3-(cyclohexylmethyl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)-1,2-benzoxazol-6-amine;N-[3-(1,1-difluoroethyl)-1-benzofuran-6-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[3-(1,1-difluoroethyl)-1-benzofuran-6-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine;3-ethyl-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)-1,2-benzoxazol-6-amine
CID 161777529
5-[7-[4-[2-[5-[5-(ethylaminomethyl)-3-pyridinyl]-1H-indazol-3-yl]-1H-imidazo[4,5-c]pyridin-4-yl]furan-2-yl]-3-[4-(furan-3-yl)-1H-imidazo[4,5-c]pyridin-2-yl]-1H-indazol-5-yl]pyridin-3-amine
CID 145034575
N-[5-[3-[7-(furan-3-yl)-3H-imidazo[4,5-b]pyridin-2-yl]-7-[4-[2-[1-methyl-6-[5-(pyrrolidin-1-ylmethyl)-3-pyridinyl]-2H-quinazolin-4-yl]-3,4-dihydroimidazo[4,5-c]azepin-8-yl]furan-2-yl]-1H-indazol-5-yl]-3-pyridinyl]benzamide
CID 145036260
1-(cyclobutylmethyl)-3-methyl-N-(7H-pyrrolo[3,4-b]pyridin-5-yl)indazol-5-amine;N-(3-cyclopropyl-1-methylindazol-6-yl)-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine;bis(N-(3-cyclopropyl-1-methylindazol-6-yl)-2H-pyrazolo[3,4-b]pyridin-3-amine);N-(1,4-dimethylindazol-6-yl)-2H-pyrazolo[3,4-b]pyridin-3-amine;N-[1-methyl-3-(1-methylcyclopropyl)indazol-6-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine;3-methyl-1-[(5-methylfuran-3-yl)methyl]-N-(7H-pyrrolo[3,4-b]pyridin-5-yl)indazol-5-amine
CID 157245191
furo[2,3-c]pyridine;furo[3,2-c]pyridine;3H-imidazo[4,5-c]pyridine;[1,2]oxazolo[4,3-c]pyridine;[1,2]oxazolo[5,4-c]pyridine;1H-pyrazolo[4,5-c]pyridine;1H-pyrazolo[5,4-c]pyridine;1H-pyrrolo[2,3-c]pyridine;1H-pyrrolo[3,2-c]pyridine;2H-pyrrolo[3,4-c]pyridine
CID 157336686
1-tert-butyl-6,7-dihydro-4H-pyrano[3,4-d]pyrazole;4-tert-butyl-2H-pyrrole;2-tert-butyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;1-tert-butyl-4,5,6,7-tetrahydropyrazolo[4,5-c]pyridine;1-tert-butyl-4,5,6,7-tetrahydropyrazolo[5,4-c]pyridine;1-tert-butyl-4,5,6,7-tetrahydropyrrolo[3,2-c]pyridine;1-tert-butyl-4,5,6,7-tetrahydro-3H-pyrrolo[3,4-c]pyridine;2-tert-butyl-4,5,6,7-tetrahydro-1H-pyrrolo[2,3-c]pyridine;3-tert-butyl-4,5,6,7-tetrahydro-1H-pyrrolo[2,3-c]pyridine;5-tert-butyl-1H-1,2,4-triazole;2-propan-2-yl-6,7-dihydro-4H-pyrano[4,3-c]pyrazole;3-propan-2-yl-1,2-oxazole;1-propan-2-ylpyrazole;2-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,3-b]pyridine;2-propan-2-yl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridine;2-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine;3-propan-2-yl-4,5,6,7-tetrahydro-1H-pyrrolo[3,4-c]pyridine
CID 157569318
2-chloro-4-(furan-2-ylmethylamino)-N-methyl-7H-pyrrolo[2,3-d]pyrimidine-5-carboxamide;2-chloro-N-(furan-2-ylmethyl)-5-(pyrrolidin-1-ylmethyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine;2-chloro-N-(1,2-oxazol-5-ylmethyl)-7H-purin-6-amine;2-chloro-N-(pyridazin-3-ylmethyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine;7-(furan-2-ylmethylamino)-2-methyl-1H-imidazo[4,5-b]pyridine-6-carboxamide
CID 157612909
4,6-dimethoxy-2-methylpyrimidine;5-fluoro-2-methylpyrimidine;6-fluoro-2-methylquinazoline;1-(furan-2-yl)ethanone;4-methoxy-2-methylpyrimidine;7-methyl-[1,2,5]oxadiazolo[3,4-d]pyrimidine;7-methyl-1H-pyrazolo[4,3-d]pyrimidine;4-methyl-3H-pyrrolo[3,2-g]quinazoline
CID 157718105

Frequently Asked Questions

What is the IUPAC name of 3-tert-butyl-2,5-dimethylfuran;4-tert-butyl-3,5-dimethyl-1,2-oxazole;4-tert-butyl-3,5-dimethyl-1H-pyrazole;5-tert-butyl-3-fluoropyridin-2-amine;3-tert-butylfuran;5-tert-butyl-1H-indole;bis(4-tert-butyl-5-methyl-1H-pyrazole);4-tert-butyl-1H-pyrazole;5-tert-butyl-1H-pyrazole;4-tert-butylpyridin-2-amine;5-tert-butylpyridin-2-amine;5-tert-butylpyrimidin-2-amine;3-tert-butyl-1H-pyrrolo[2,3-b]pyridine;5-tert-butyl-1H-pyrrolo[2,3-b]pyridine?
The IUPAC name of 3-tert-butyl-2,5-dimethylfuran;4-tert-butyl-3,5-dimethyl-1,2-oxazole;4-tert-butyl-3,5-dimethyl-1H-pyrazole;5-tert-butyl-3-fluoropyridin-2-amine;3-tert-butylfuran;5-tert-butyl-1H-indole;bis(4-tert-butyl-5-methyl-1H-pyrazole);4-tert-butyl-1H-pyrazole;5-tert-butyl-1H-pyrazole;4-tert-butylpyridin-2-amine;5-tert-butylpyridin-2-amine;5-tert-butylpyrimidin-2-amine;3-tert-butyl-1H-pyrrolo[2,3-b]pyridine;5-tert-butyl-1H-pyrrolo[2,3-b]pyridine (CID 161065488) is 3-tert-butyl-2,5-dimethylfuran;4-tert-butyl-3,5-dimethyl-1,2-oxazole;4-tert-butyl-3,5-dimethyl-1H-pyrazole;5-tert-butyl-3-fluoropyridin-2-amine;3-tert-butylfuran;5-tert-butyl-1H-indole;bis(4-tert-butyl-5-methyl-1H-pyrazole);4-tert-butyl-1H-pyrazole;5-tert-butyl-1H-pyrazole;4-tert-butylpyridin-2-amine;5-tert-butylpyridin-2-amine;5-tert-butylpyrimidin-2-amine;3-tert-butyl-1H-pyrrolo[2,3-b]pyridine;5-tert-butyl-1H-pyrrolo[2,3-b]pyridine.
What is the SMILES notation for 3-tert-butyl-2,5-dimethylfuran;4-tert-butyl-3,5-dimethyl-1,2-oxazole;4-tert-butyl-3,5-dimethyl-1H-pyrazole;5-tert-butyl-3-fluoropyridin-2-amine;3-tert-butylfuran;5-tert-butyl-1H-indole;bis(4-tert-butyl-5-methyl-1H-pyrazole);4-tert-butyl-1H-pyrazole;5-tert-butyl-1H-pyrazole;4-tert-butylpyridin-2-amine;5-tert-butylpyridin-2-amine;5-tert-butylpyrimidin-2-amine;3-tert-butyl-1H-pyrrolo[2,3-b]pyridine;5-tert-butyl-1H-pyrrolo[2,3-b]pyridine?
The canonical SMILES for 3-tert-butyl-2,5-dimethylfuran;4-tert-butyl-3,5-dimethyl-1,2-oxazole;4-tert-butyl-3,5-dimethyl-1H-pyrazole;5-tert-butyl-3-fluoropyridin-2-amine;3-tert-butylfuran;5-tert-butyl-1H-indole;bis(4-tert-butyl-5-methyl-1H-pyrazole);4-tert-butyl-1H-pyrazole;5-tert-butyl-1H-pyrazole;4-tert-butylpyridin-2-amine;5-tert-butylpyridin-2-amine;5-tert-butylpyrimidin-2-amine;3-tert-butyl-1H-pyrrolo[2,3-b]pyridine;5-tert-butyl-1H-pyrrolo[2,3-b]pyridine is CC(C)(C)c1c[nH]c2ncccc12.CC(C)(C)c1ccc(N)nc1.CC(C)(C)c1ccc2[nH]ccc2c1.CC(C)(C)c1ccn[nH]1.CC(C)(C)c1ccnc(N)c1.CC(C)(C)c1ccoc1.CC(C)(C)c1cn[nH]c1.CC(C)(C)c1cnc(N)c(F)c1.CC(C)(C)c1cnc(N)nc1.CC(C)(C)c1cnc2[nH]ccc2c1.Cc1[nH]ncc1C(C)(C)C.Cc1[nH]ncc1C(C)(C)C.Cc1cc(C(C)(C)C)c(C)o1.Cc1n[nH]c(C)c1C(C)(C)C.Cc1noc(C)c1C(C)(C)C.
What is the InChIKey of 3-tert-butyl-2,5-dimethylfuran;4-tert-butyl-3,5-dimethyl-1,2-oxazole;4-tert-butyl-3,5-dimethyl-1H-pyrazole;5-tert-butyl-3-fluoropyridin-2-amine;3-tert-butylfuran;5-tert-butyl-1H-indole;bis(4-tert-butyl-5-methyl-1H-pyrazole);4-tert-butyl-1H-pyrazole;5-tert-butyl-1H-pyrazole;4-tert-butylpyridin-2-amine;5-tert-butylpyridin-2-amine;5-tert-butylpyrimidin-2-amine;3-tert-butyl-1H-pyrrolo[2,3-b]pyridine;5-tert-butyl-1H-pyrrolo[2,3-b]pyridine?
The InChIKey is UDYVDZXCIRAPMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N.2C11H14N2.C10H16O.C9H13FN2.C9H16N2.2C9H14N2.C9H15NO.C8H13N3.2C8H14N2.C8H12O.2C7H12N2/c1-12(2,3)10-4-5-11-9(8-10)6-7-13-11;1-11(2,3)9-6-8-4-5-12-10(8)13-7-9;1-11(2,3)9-7-13-10-8(9)5-4-6-12-10;1-7-6-9(8(2)11-7)10(3,4)5;1-9(2,3)6-4-7(10)8(11)12-5-6;1-6-8(9(3,4)5)7(2)11-10-6;1-9(2,3)7-4-5-11-8(10)6-7;1-9(2,3)7-4-5-8(10)11-6-7;1-6-8(9(3,4)5)7(2)11-10-6;1-8(2,3)6-4-10-7(9)11-5-6;2*1-6-7(5-9-10-6)8(2,3)4;1-8(2,3)7-4-5-9-6-7;1-7(2,3)6-4-8-9-5-6;1-7(2,3)6-4-5-8-9-6/h4-8,13H,1-3H3;2*4-7H,1-3H3,(H,12,13);6H,1-5H3;4-5H,1-3H3,(H2,11,12);1-5H3,(H,10,11);2*4-6H,1-3H3,(H2,10,11);1-5H3;4-5H,1-3H3,(H2,9,10,11);2*5H,1-4H3,(H,9,10);4-6H,1-3H3;2*4-5H,1-3H3,(H,8,9).
What are the key properties of 3-tert-butyl-2,5-dimethylfuran;4-tert-butyl-3,5-dimethyl-1,2-oxazole;4-tert-butyl-3,5-dimethyl-1H-pyrazole;5-tert-butyl-3-fluoropyridin-2-amine;3-tert-butylfuran;5-tert-butyl-1H-indole;bis(4-tert-butyl-5-methyl-1H-pyrazole);4-tert-butyl-1H-pyrazole;5-tert-butyl-1H-pyrazole;4-tert-butylpyridin-2-amine;5-tert-butylpyridin-2-amine;5-tert-butylpyrimidin-2-amine;3-tert-butyl-1H-pyrrolo[2,3-b]pyridine;5-tert-butyl-1H-pyrrolo[2,3-b]pyridine?
3-tert-butyl-2,5-dimethylfuran;4-tert-butyl-3,5-dimethyl-1,2-oxazole;4-tert-butyl-3,5-dimethyl-1H-pyrazole;5-tert-butyl-3-fluoropyridin-2-amine;3-tert-butylfuran;5-tert-butyl-1H-indole;bis(4-tert-butyl-5-methyl-1H-pyrazole);4-tert-butyl-1H-pyrazole;5-tert-butyl-1H-pyrazole;4-tert-butylpyridin-2-amine;5-tert-butylpyridin-2-amine;5-tert-butylpyrimidin-2-amine;3-tert-butyl-1H-pyrrolo[2,3-b]pyridine;5-tert-butyl-1H-pyrrolo[2,3-b]pyridine has a molecular weight of 2248.32 g/mol, XLogP of 34.70, 0 rotatable bonds, 12 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 3-tert-butyl-2,5-dimethylfuran;4-tert-butyl-3,5-dimethyl-1,2-oxazole;4-tert-butyl-3,5-dimethyl-1H-pyrazole;5-tert-butyl-3-fluoropyridin-2-amine;3-tert-butylfuran;5-tert-butyl-1H-indole;bis(4-tert-butyl-5-methyl-1H-pyrazole);4-tert-butyl-1H-pyrazole;5-tert-butyl-1H-pyrazole;4-tert-butylpyridin-2-amine;5-tert-butylpyridin-2-amine;5-tert-butylpyrimidin-2-amine;3-tert-butyl-1H-pyrrolo[2,3-b]pyridine;5-tert-butyl-1H-pyrrolo[2,3-b]pyridine is sourced from PubChem (CID 161065488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).