4-imidazol-1-ylpyridin-3-amine;4-(2-methylimidazol-1-yl)pyridin-3-amine;4-(3-methyl-1,2,4-triazol-1-yl)pyridin-3-amine;4-(5-methyl-1,2,4-triazol-1-yl)pyridin-3-amine;4-[2-methyl-4-(trifluoromethyl)imidazol-1-yl]pyridin-3-amine;4-[4-(trifluoromethyl)imidazol-1-yl]pyridin-3-amine

C52H52F6N26 — CID 159224061

IUPAC4-imidazol-1-ylpyridin-3-amine;4-(2-methylimidazol-1-yl)pyridin-3-amine;4-(3-methyl-1,2,4-triazol-1-yl)pyridin-3-amine;4-(5-methyl-1,2,4-triazol-1-yl)pyridin-3-amine;4-[2-methyl-4-(trifluoromethyl)imidazol-1-yl]pyridin-3-amine;4-[4-(trifluoromethyl)imidazol-1-yl]pyridin-3-amine
SMILESCc1nc(C(F)(F)F)cn1-c1ccncc1N.Cc1nccn1-c1ccncc1N.Cc1ncn(-c2ccncc2N)n1.Cc1ncnn1-c1ccncc1N.Nc1cnccc1-n1ccnc1.Nc1cnccc1-n1cnc(C(F)(F)F)c1
InChIInChI=1S/C10H9F3N4.C9H7F3N4.C9H10N4.2C8H9N5.C8H8N4/c1-6-16-9(10(11,12)13)5-17(6)8-2-3-15-4-7(8)14;10-9(11,12)8-4-16(5-15-8)7-1-2-14-3-6(7)13;1-7-12-4-5-13(7)9-2-3-11-6-8(9)10;1-6-11-5-13(12-6)8-2-3-10-4-7(8)9;1-6-11-5-12-13(6)8-2-3-10-4-7(8)9;9-7-5-10-2-1-8(7)12-4-3-11-6-12/h2-5H,14H2,1H3;1-5H,13H2;2-6H,10H2,1H3;2*2-5H,9H2,1H3;1-6H,9H2
InChIKeyKSBFFKSWRWHHBX-UHFFFAOYSA-N
MW1155.16 g/mol
LogP7.16
Rot. Bonds6

About 4-imidazol-1-ylpyridin-3-amine;4-(2-methylimidazol-1-yl)pyridin-3-amine;4-(3-methyl-1,2,4-triazol-1-yl)pyridin-3-amine;4-(5-methyl-1,2,4-triazol-1-yl)pyridin-3-amine;4-[2-methyl-4-(trifluoromethyl)imidazol-1-yl]pyridin-3-amine;4-[4-(trifluoromethyl)imidazol-1-yl]pyridin-3-amine

4-imidazol-1-ylpyridin-3-amine;4-(2-methylimidazol-1-yl)pyridin-3-amine;4-(3-methyl-1,2,4-triazol-1-yl)pyridin-3-amine;4-(5-methyl-1,2,4-triazol-1-yl)pyridin-3-amine;4-[2-methyl-4-(trifluoromethyl)imidazol-1-yl]pyridin-3-amine;4-[4-(trifluoromethyl)imidazol-1-yl]pyridin-3-amine (PubChem CID 159224061) has the molecular formula C52H52F6N26 and a molecular weight of 1155.16 g/mol. Its IUPAC name is 4-imidazol-1-ylpyridin-3-amine;4-(2-methylimidazol-1-yl)pyridin-3-amine;4-(3-methyl-1,2,4-triazol-1-yl)pyridin-3-amine;4-(5-methyl-1,2,4-triazol-1-yl)pyridin-3-amine;4-[2-methyl-4-(trifluoromethyl)imidazol-1-yl]pyridin-3-amine;4-[4-(trifluoromethyl)imidazol-1-yl]pyridin-3-amine.

Molecular Properties

Compound Name4-imidazol-1-ylpyridin-3-amine;4-(2-methylimidazol-1-yl)pyridin-3-amine;4-(3-methyl-1,2,4-triazol-1-yl)pyridin-3-amine;4-(5-methyl-1,2,4-triazol-1-yl)pyridin-3-amine;4-[2-methyl-4-(trifluoromethyl)imidazol-1-yl]pyridin-3-amine;4-[4-(trifluoromethyl)imidazol-1-yl]pyridin-3-amine
PubChem CID159224061
Molecular FormulaC52H52F6N26
Molecular Weight1155.16 g/mol
Exact Mass1154.48
IUPAC Name4-imidazol-1-ylpyridin-3-amine;4-(2-methylimidazol-1-yl)pyridin-3-amine;4-(3-methyl-1,2,4-triazol-1-yl)pyridin-3-amine;4-(5-methyl-1,2,4-triazol-1-yl)pyridin-3-amine;4-[2-methyl-4-(trifluoromethyl)imidazol-1-yl]pyridin-3-amine;4-[4-(trifluoromethyl)imidazol-1-yl]pyridin-3-amine
SMILESCc1nc(C(F)(F)F)cn1-c1ccncc1N.Cc1nccn1-c1ccncc1N.Cc1ncn(-c2ccncc2N)n1.Cc1ncnn1-c1ccncc1N.Nc1cnccc1-n1ccnc1.Nc1cnccc1-n1cnc(C(F)(F)F)c1
InChIInChI=1S/C10H9F3N4.C9H7F3N4.C9H10N4.2C8H9N5.C8H8N4/c1-6-16-9(10(11,12)13)5-17(6)8-2-3-15-4-7(8)14;10-9(11,12)8-4-16(5-15-8)7-1-2-14-3-6(7)13;1-7-12-4-5-13(7)9-2-3-11-6-8(9)10;1-6-11-5-13(12-6)8-2-3-10-4-7(8)9;1-6-11-5-12-13(6)8-2-3-10-4-7(8)9;9-7-5-10-2-1-8(7)12-4-3-11-6-12/h2-5H,14H2,1H3;1-5H,13H2;2-6H,10H2,1H3;2*2-5H,9H2,1H3;1-6H,9H2
InChIKeyKSBFFKSWRWHHBX-UHFFFAOYSA-N
XLogP7.16
TPSA366.16 Ų
H-Bond Donors6
H-Bond Acceptors26
Rotatable Bonds6
Heavy Atoms84
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001155.16
LogP ≤ 57.16
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1026

Analyze 4-imidazol-1-ylpyridin-3-amine;4-(2-methylimidazol-1-yl)pyridin-3-amine;4-(3-methyl-1,2,4-triazol-1-yl)pyridin-3-amine;4-(5-methyl-1,2,4-triazol-1-yl)pyridin-3-amine;4-[2-methyl-4-(trifluoromethyl)imidazol-1-yl]pyridin-3-amine;4-[4-(trifluoromethyl)imidazol-1-yl]pyridin-3-amine with MolForge

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Related Compounds

3-[2-[5-Methyl-1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-4,5-dihydroimidazol-1-yl]pyridine;3-[2-[5-methyl-1-(2,2,2-trifluoroethyl)pyrazol-4-yl]imidazol-1-yl]pyridine
CID 88532650
4-[(7S)-5-[difluoro-(2-fluorophenyl)methyl]-7-methyl-3,4,6,9-tetrazatricyclo[7.3.0.02,6]dodeca-1(12),2,4,10-tetraen-11-yl]-6-[5-[[4-[(7S)-5-[difluoro-(2-fluorophenyl)methyl]-7-methyl-3,4,6,9-tetrazatricyclo[7.3.0.02,6]dodeca-1(12),2,4,10-tetraen-11-yl]-5-methylpyrimidin-2-yl]amino]-1-ethylpyrazol-3-yl]-N-(4-fluoro-1-methylpyrazol-5-yl)-5-methylpyrimidin-2-amine
CID 155376550
4-[5-[[4-[(7S)-5-[difluoro-(2-fluorophenyl)methyl]-7-methyl-3,4,6,9-tetrazatricyclo[7.3.0.02,6]dodeca-1(12),2,4,10-tetraen-11-yl]-5-methylpyrimidin-2-yl]amino]-1-(difluoromethyl)pyrazol-3-yl]-6-[(7R)-5-[(2,4-difluorophenyl)-difluoromethyl]-7-(fluoromethyl)-3,4,6,9-tetrazatricyclo[7.3.0.02,6]dodeca-1(12),2,4,10-tetraen-11-yl]-5-methyl-N-(2-methylpyrazol-3-yl)pyrimidin-2-amine
CID 155376640
11'-Tert-butyl-4',11-dimethyl-4-(trifluoromethyl)spiro[3,5,6-triaza-8-azoniatricyclo[6.4.0.02,6]dodeca-1(8),2,4,9,11-pentaene-7,7'-5,6-diaza-8-azoniatricyclo[6.4.0.02,6]dodeca-1(8),2,4,9,11-pentaene];4',10-dimethyl-4-(trifluoromethyl)spiro[3,5,6,11-tetraza-8-azoniatricyclo[6.4.0.02,6]dodeca-1(12),2,4,8,10-pentaene-7,7'-3,5,6-triaza-8-azoniatricyclo[6.4.0.02,6]dodeca-1(12),2,4,8,10-pentaene];4',11-dimethyl-4-(trifluoromethyl)spiro[3,5,6-triaza-8-azoniatricyclo[6.4.0.02,6]dodeca-1(8),2,4,9,11-pentaene-7,7'-5,6-diaza-8-azoniatricyclo[6.4.0.02,6]dodeca-1(12),2,4,8,10-pentaene]
CID 157055443
2-(1,2-diaza-3-azanidacyclopenta-1,4-dien-4-yl)pyridine;heptakis(1-(4-fluorobenzene-6-id-1-yl)-3-methyl-2H-imidazol-3-ium-2-ide);tetrakis(iridium);1-methyl-3-phenyl-2H-imidazol-1-ium-2-ide;2-pyrazol-2-id-3-ylpyridine;2-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-yl)pyridine;2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine
CID 157098318
3-Methyl-5-(1-methylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-phenylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-propan-2-ylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;tris(platinum(2+));tris(2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine)
CID 157321857
2-(1,2-diaza-3-azanidacyclopenta-1,4-dien-4-yl)pyridine;octakis(1-(2,4-difluorobenzene-6-id-1-yl)-3-methyl-2H-imidazol-3-ium-2-ide);tetrakis(iridium);2-(5-methyl-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl)pyridine;2-pyrazol-2-id-3-ylpyridine;2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine
CID 157368271
2-(1,2-diaza-3-azanidacyclopenta-1,4-dien-4-yl)pyridine;tetrakis(iridium);2-(5-methyl-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl)pyridine;octakis(1-phenyl-3-phenyl-2H-imidazol-1-ium-2-ide);2-pyrazol-2-id-3-ylpyridine;2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine
CID 157372083
2-(5-tert-butyl-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl)pyridine;2-(5-tert-butyl-1H-1,2,4-triazol-3-yl)pyridine;iridium(3+);bis(2-methyl-4-pyridin-2-yl-5H-pyrimidin-5-ide);4-pyridin-2-yl-2-(trifluoromethyl)pyrimidine
CID 157386607
2-(1,2-diaza-3-azanidacyclopenta-1,4-dien-4-yl)pyridine;hexakis(1-(3-fluorobenzene-6-id-1-yl)-3-(3-fluorophenyl)-4,5-dimethyl-2H-imidazol-3-ium-2-ide);tris(iridium);2-pyrazol-2-id-3-ylpyridine;2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine
CID 157470651
3-Methyl-5-(1-methylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-phenylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-propan-2-ylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;tris(platinum(2+));tris(2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine)
CID 157532414
2,6-bis(5-tert-butyl-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl)pyridine;3,5-bis(1-methylimidazol-2-yl)-4H-pyridin-4-ide;2,6-bis[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine;methylbenzene;tris(platinum(2+));bis(pyridine)
CID 157554926

Frequently Asked Questions

What is the IUPAC name of 4-imidazol-1-ylpyridin-3-amine;4-(2-methylimidazol-1-yl)pyridin-3-amine;4-(3-methyl-1,2,4-triazol-1-yl)pyridin-3-amine;4-(5-methyl-1,2,4-triazol-1-yl)pyridin-3-amine;4-[2-methyl-4-(trifluoromethyl)imidazol-1-yl]pyridin-3-amine;4-[4-(trifluoromethyl)imidazol-1-yl]pyridin-3-amine?
The IUPAC name of 4-imidazol-1-ylpyridin-3-amine;4-(2-methylimidazol-1-yl)pyridin-3-amine;4-(3-methyl-1,2,4-triazol-1-yl)pyridin-3-amine;4-(5-methyl-1,2,4-triazol-1-yl)pyridin-3-amine;4-[2-methyl-4-(trifluoromethyl)imidazol-1-yl]pyridin-3-amine;4-[4-(trifluoromethyl)imidazol-1-yl]pyridin-3-amine (CID 159224061) is 4-imidazol-1-ylpyridin-3-amine;4-(2-methylimidazol-1-yl)pyridin-3-amine;4-(3-methyl-1,2,4-triazol-1-yl)pyridin-3-amine;4-(5-methyl-1,2,4-triazol-1-yl)pyridin-3-amine;4-[2-methyl-4-(trifluoromethyl)imidazol-1-yl]pyridin-3-amine;4-[4-(trifluoromethyl)imidazol-1-yl]pyridin-3-amine.
What is the SMILES notation for 4-imidazol-1-ylpyridin-3-amine;4-(2-methylimidazol-1-yl)pyridin-3-amine;4-(3-methyl-1,2,4-triazol-1-yl)pyridin-3-amine;4-(5-methyl-1,2,4-triazol-1-yl)pyridin-3-amine;4-[2-methyl-4-(trifluoromethyl)imidazol-1-yl]pyridin-3-amine;4-[4-(trifluoromethyl)imidazol-1-yl]pyridin-3-amine?
The canonical SMILES for 4-imidazol-1-ylpyridin-3-amine;4-(2-methylimidazol-1-yl)pyridin-3-amine;4-(3-methyl-1,2,4-triazol-1-yl)pyridin-3-amine;4-(5-methyl-1,2,4-triazol-1-yl)pyridin-3-amine;4-[2-methyl-4-(trifluoromethyl)imidazol-1-yl]pyridin-3-amine;4-[4-(trifluoromethyl)imidazol-1-yl]pyridin-3-amine is Cc1nc(C(F)(F)F)cn1-c1ccncc1N.Cc1nccn1-c1ccncc1N.Cc1ncn(-c2ccncc2N)n1.Cc1ncnn1-c1ccncc1N.Nc1cnccc1-n1ccnc1.Nc1cnccc1-n1cnc(C(F)(F)F)c1.
What is the InChIKey of 4-imidazol-1-ylpyridin-3-amine;4-(2-methylimidazol-1-yl)pyridin-3-amine;4-(3-methyl-1,2,4-triazol-1-yl)pyridin-3-amine;4-(5-methyl-1,2,4-triazol-1-yl)pyridin-3-amine;4-[2-methyl-4-(trifluoromethyl)imidazol-1-yl]pyridin-3-amine;4-[4-(trifluoromethyl)imidazol-1-yl]pyridin-3-amine?
The InChIKey is KSBFFKSWRWHHBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9F3N4.C9H7F3N4.C9H10N4.2C8H9N5.C8H8N4/c1-6-16-9(10(11,12)13)5-17(6)8-2-3-15-4-7(8)14;10-9(11,12)8-4-16(5-15-8)7-1-2-14-3-6(7)13;1-7-12-4-5-13(7)9-2-3-11-6-8(9)10;1-6-11-5-13(12-6)8-2-3-10-4-7(8)9;1-6-11-5-12-13(6)8-2-3-10-4-7(8)9;9-7-5-10-2-1-8(7)12-4-3-11-6-12/h2-5H,14H2,1H3;1-5H,13H2;2-6H,10H2,1H3;2*2-5H,9H2,1H3;1-6H,9H2.
What are the key properties of 4-imidazol-1-ylpyridin-3-amine;4-(2-methylimidazol-1-yl)pyridin-3-amine;4-(3-methyl-1,2,4-triazol-1-yl)pyridin-3-amine;4-(5-methyl-1,2,4-triazol-1-yl)pyridin-3-amine;4-[2-methyl-4-(trifluoromethyl)imidazol-1-yl]pyridin-3-amine;4-[4-(trifluoromethyl)imidazol-1-yl]pyridin-3-amine?
4-imidazol-1-ylpyridin-3-amine;4-(2-methylimidazol-1-yl)pyridin-3-amine;4-(3-methyl-1,2,4-triazol-1-yl)pyridin-3-amine;4-(5-methyl-1,2,4-triazol-1-yl)pyridin-3-amine;4-[2-methyl-4-(trifluoromethyl)imidazol-1-yl]pyridin-3-amine;4-[4-(trifluoromethyl)imidazol-1-yl]pyridin-3-amine has a molecular weight of 1155.16 g/mol, XLogP of 7.16, 6 rotatable bonds, 6 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for 4-imidazol-1-ylpyridin-3-amine;4-(2-methylimidazol-1-yl)pyridin-3-amine;4-(3-methyl-1,2,4-triazol-1-yl)pyridin-3-amine;4-(5-methyl-1,2,4-triazol-1-yl)pyridin-3-amine;4-[2-methyl-4-(trifluoromethyl)imidazol-1-yl]pyridin-3-amine;4-[4-(trifluoromethyl)imidazol-1-yl]pyridin-3-amine is sourced from PubChem (CID 159224061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).