2-amino-8-hydroxy-4-(1,3,5-trimethylpyrazol-4-yl)-5H-indeno[1,2-b]pyridine-3-carbonitrile

C19H17N5O — CID 56919260

IUPAC2-amino-8-hydroxy-4-(1,3,5-trimethylpyrazol-4-yl)-5H-indeno[1,2-b]pyridine-3-carbonitrile
SMILESCc1nn(C)c(C)c1-c1c(C#N)c(N)nc2c1Cc1ccc(O)cc1-2
InChIInChI=1S/C19H17N5O/c1-9-16(10(2)24(3)23-9)17-14-6-11-4-5-12(25)7-13(11)18(14)22-19(21)15(17)8-20/h4-5,7,25H,6H2,1-3H3,(H2,21,22)
InChIKeyAKCSATSKLLHMCT-UHFFFAOYSA-N
MW331.38 g/mol
LogP2.83
Rot. Bonds1

About 2-amino-8-hydroxy-4-(1,3,5-trimethylpyrazol-4-yl)-5H-indeno[1,2-b]pyridine-3-carbonitrile

2-amino-8-hydroxy-4-(1,3,5-trimethylpyrazol-4-yl)-5H-indeno[1,2-b]pyridine-3-carbonitrile (PubChem CID 56919260) has the molecular formula C19H17N5O and a molecular weight of 331.38 g/mol. Its IUPAC name is 2-amino-8-hydroxy-4-(1,3,5-trimethylpyrazol-4-yl)-5H-indeno[1,2-b]pyridine-3-carbonitrile.

Molecular Properties

Compound Name2-amino-8-hydroxy-4-(1,3,5-trimethylpyrazol-4-yl)-5H-indeno[1,2-b]pyridine-3-carbonitrile
PubChem CID56919260
Molecular FormulaC19H17N5O
Molecular Weight331.38 g/mol
Exact Mass331.14
IUPAC Name2-amino-8-hydroxy-4-(1,3,5-trimethylpyrazol-4-yl)-5H-indeno[1,2-b]pyridine-3-carbonitrile
SMILESCc1nn(C)c(C)c1-c1c(C#N)c(N)nc2c1Cc1ccc(O)cc1-2
InChIInChI=1S/C19H17N5O/c1-9-16(10(2)24(3)23-9)17-14-6-11-4-5-12(25)7-13(11)18(14)22-19(21)15(17)8-20/h4-5,7,25H,6H2,1-3H3,(H2,21,22)
InChIKeyAKCSATSKLLHMCT-UHFFFAOYSA-N
XLogP2.83
TPSA100.75 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.38
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-amino-7-hydroxy-4-(1H-pyrrol-2-yl)-5H-indeno[1,2-b]pyridine-3-carbonitrile
CID 177315480
2-amino-4-(4-fluorophenyl)-6-(1,3,5-trimethylpyrazol-4-yl)pyridine-3-carbonitrile
CID 56865430
2,4-diamino-6-(2,4-dihydroxyphenyl)pyrimidine-5-carbonitrile
CID 169395987
2,4-diamino-6-(5-hydroxy-2-iodophenyl)pyrimidine-5-carbonitrile
CID 169397267
2-amino-6-(4-hydroxyphenyl)-5-methyl-4-(5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepin-2-yl)pyridine-3-carbonitrile;hydrochloride
CID 171707452
2-amino-6-hydroxy-4-propyl-5H-indeno[1,2-b]pyridine-3-carbonitrile
CID 56874199
2-amino-6-(1,3-benzodioxol-5-yl)-4-(1,3-dimethylpyrazol-4-yl)-5-methylpyridine-3-carbonitrile
CID 56866597
1-methyl-2-(1,3,5-trimethylpyrazol-4-yl)benzimidazole-4-carbonitrile
CID 104720742
2-(4-chlorophenyl)-4-(4-hydroxyphenyl)-5H-indeno[1,2-b]pyridin-8-ol
CID 155518317
2-amino-4-(3-ethoxy-4-hydroxyphenyl)-5,6-dihydrobenzo[h]quinoline-3-carbonitrile
CID 1132555
2-amino-6-(4-hydroxyphenyl)-5-methyl-4-(1H-pyrazol-5-yl)pyridine-3-carbonitrile
CID 169411353
2-amino-4-(5-hydroxy-2-methoxyphenyl)-6-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)pyridine-3-carbonitrile
CID 169411886

Frequently Asked Questions

What is the IUPAC name of 2-amino-8-hydroxy-4-(1,3,5-trimethylpyrazol-4-yl)-5H-indeno[1,2-b]pyridine-3-carbonitrile?
The IUPAC name of 2-amino-8-hydroxy-4-(1,3,5-trimethylpyrazol-4-yl)-5H-indeno[1,2-b]pyridine-3-carbonitrile (CID 56919260) is 2-amino-8-hydroxy-4-(1,3,5-trimethylpyrazol-4-yl)-5H-indeno[1,2-b]pyridine-3-carbonitrile.
What is the SMILES notation for 2-amino-8-hydroxy-4-(1,3,5-trimethylpyrazol-4-yl)-5H-indeno[1,2-b]pyridine-3-carbonitrile?
The canonical SMILES for 2-amino-8-hydroxy-4-(1,3,5-trimethylpyrazol-4-yl)-5H-indeno[1,2-b]pyridine-3-carbonitrile is Cc1nn(C)c(C)c1-c1c(C#N)c(N)nc2c1Cc1ccc(O)cc1-2.
What is the InChIKey of 2-amino-8-hydroxy-4-(1,3,5-trimethylpyrazol-4-yl)-5H-indeno[1,2-b]pyridine-3-carbonitrile?
The InChIKey is AKCSATSKLLHMCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N5O/c1-9-16(10(2)24(3)23-9)17-14-6-11-4-5-12(25)7-13(11)18(14)22-19(21)15(17)8-20/h4-5,7,25H,6H2,1-3H3,(H2,21,22).
What are the key properties of 2-amino-8-hydroxy-4-(1,3,5-trimethylpyrazol-4-yl)-5H-indeno[1,2-b]pyridine-3-carbonitrile?
2-amino-8-hydroxy-4-(1,3,5-trimethylpyrazol-4-yl)-5H-indeno[1,2-b]pyridine-3-carbonitrile has a molecular weight of 331.38 g/mol, XLogP of 2.83, 1 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-8-hydroxy-4-(1,3,5-trimethylpyrazol-4-yl)-5H-indeno[1,2-b]pyridine-3-carbonitrile is sourced from PubChem (CID 56919260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).