2-amino-4-(2-aminopropyl)-6-(2-hydroxyphenyl)pyridine-3-carbonitrile

C15H16N4O — CID 135584959

IUPAC2-amino-4-(2-aminopropyl)-6-(2-hydroxyphenyl)pyridine-3-carbonitrile
SMILESCC(N)Cc1cc(-c2ccccc2O)nc(N)c1C#N
InChIInChI=1S/C15H16N4O/c1-9(17)6-10-7-13(19-15(18)12(10)8-16)11-4-2-3-5-14(11)20/h2-5,7,9,20H,6,17H2,1H3,(H2,18,19)
InChIKeyFCQJROZHCJNAHL-UHFFFAOYSA-N
MW268.32 g/mol
LogP1.80
Rot. Bonds3

About 2-amino-4-(2-aminopropyl)-6-(2-hydroxyphenyl)pyridine-3-carbonitrile

2-amino-4-(2-aminopropyl)-6-(2-hydroxyphenyl)pyridine-3-carbonitrile (PubChem CID 135584959) has the molecular formula C15H16N4O and a molecular weight of 268.32 g/mol. Its IUPAC name is 2-amino-4-(2-aminopropyl)-6-(2-hydroxyphenyl)pyridine-3-carbonitrile.

Molecular Properties

Compound Name2-amino-4-(2-aminopropyl)-6-(2-hydroxyphenyl)pyridine-3-carbonitrile
PubChem CID135584959
Molecular FormulaC15H16N4O
Molecular Weight268.32 g/mol
Exact Mass268.13
IUPAC Name2-amino-4-(2-aminopropyl)-6-(2-hydroxyphenyl)pyridine-3-carbonitrile
SMILESCC(N)Cc1cc(-c2ccccc2O)nc(N)c1C#N
InChIInChI=1S/C15H16N4O/c1-9(17)6-10-7-13(19-15(18)12(10)8-16)11-4-2-3-5-14(11)20/h2-5,7,9,20H,6,17H2,1H3,(H2,18,19)
InChIKeyFCQJROZHCJNAHL-UHFFFAOYSA-N
XLogP1.80
TPSA108.95 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 51.80
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-Amino-6-(4-hydroxyphenyl)-4-phenylpyridine-3-carbonitrile
CID 791050
2-({[2-({(3s,4s)-4-[(6-Amino-4-Methylpyridin-2-Yl)methyl]pyrrolidin-3-Yl}oxy)ethyl]amino}methyl)phenol
CID 56835763
4-Methyl-2-[[(6-methylpyridin-2-yl)amino]methyl]phenol
CID 890931
2-Amino-6-(2-hydroxyphenyl)-4-(piperidin-3-yl)nicotinonitrile
CID 135432858
N-{3-[2-Amino-3-cyano-6-(2-hydroxyphenyl)pyridin-4-yl]phenyl}-3-(piperidin-1-yl)propanamide
CID 135456003
2-Amino-5-fluoro-6-(2-hydroxyphenyl)-4-piperidin-3-ylpyridine-3-carbonitrile
CID 135550601
2-Amino-4-(2-amino-2-phenylethyl)-6-(2-hydroxyphenyl)pyridine-3-carbonitrile
CID 135584957
2-Amino-4-(2-amino-ethyl)-6-(2-hydroxy-phenyl)-nicotinonitrile
CID 135584958
2-Amino-6-(2,6-dihydroxyphenyl)-4-(3-piperidinyl)-3-pyridinecarbonitrile
CID 135584961
2-Amino-6-(2,6-dihydroxyphenyl)-4-(4-piperidinyl)-3-pyridinecarbonitrile
CID 135584962
2-Amino-6-(2-hydroxy-6-methoxyphenyl)-4-(3-piperidinyl)-3-pyridinecarbonitrile
CID 135584974
2-Amino-6-(2-hydroxyphenyl)-4-(1-methylpiperidin-3-yl)pyridine-3-carbonitrile
CID 135584978

Frequently Asked Questions

What is the IUPAC name of 2-amino-4-(2-aminopropyl)-6-(2-hydroxyphenyl)pyridine-3-carbonitrile?
The IUPAC name of 2-amino-4-(2-aminopropyl)-6-(2-hydroxyphenyl)pyridine-3-carbonitrile (CID 135584959) is 2-amino-4-(2-aminopropyl)-6-(2-hydroxyphenyl)pyridine-3-carbonitrile.
What is the SMILES notation for 2-amino-4-(2-aminopropyl)-6-(2-hydroxyphenyl)pyridine-3-carbonitrile?
The canonical SMILES for 2-amino-4-(2-aminopropyl)-6-(2-hydroxyphenyl)pyridine-3-carbonitrile is CC(N)Cc1cc(-c2ccccc2O)nc(N)c1C#N.
What is the InChIKey of 2-amino-4-(2-aminopropyl)-6-(2-hydroxyphenyl)pyridine-3-carbonitrile?
The InChIKey is FCQJROZHCJNAHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O/c1-9(17)6-10-7-13(19-15(18)12(10)8-16)11-4-2-3-5-14(11)20/h2-5,7,9,20H,6,17H2,1H3,(H2,18,19).
What are the key properties of 2-amino-4-(2-aminopropyl)-6-(2-hydroxyphenyl)pyridine-3-carbonitrile?
2-amino-4-(2-aminopropyl)-6-(2-hydroxyphenyl)pyridine-3-carbonitrile has a molecular weight of 268.32 g/mol, XLogP of 1.80, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-(2-aminopropyl)-6-(2-hydroxyphenyl)pyridine-3-carbonitrile is sourced from PubChem (CID 135584959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).