2-amino-6-(2-hydroxyphenyl)-4-piperidin-4-ylpyridine-3-carbonitrile

C17H18N4O — CID 135584981

IUPAC2-amino-6-(2-hydroxyphenyl)-4-piperidin-4-ylpyridine-3-carbonitrile
SMILESN#Cc1c(C2CCNCC2)cc(-c2ccccc2O)nc1N
InChIInChI=1S/C17H18N4O/c18-10-14-13(11-5-7-20-8-6-11)9-15(21-17(14)19)12-3-1-2-4-16(12)22/h1-4,9,11,20,22H,5-8H2,(H2,19,21)
InChIKeyMTGPCCDPOBAGGW-UHFFFAOYSA-N
MW294.36 g/mol
LogP2.38
Rot. Bonds2

About 2-amino-6-(2-hydroxyphenyl)-4-piperidin-4-ylpyridine-3-carbonitrile

2-amino-6-(2-hydroxyphenyl)-4-piperidin-4-ylpyridine-3-carbonitrile (PubChem CID 135584981) has the molecular formula C17H18N4O and a molecular weight of 294.36 g/mol. Its IUPAC name is 2-amino-6-(2-hydroxyphenyl)-4-piperidin-4-ylpyridine-3-carbonitrile.

Molecular Properties

Compound Name2-amino-6-(2-hydroxyphenyl)-4-piperidin-4-ylpyridine-3-carbonitrile
PubChem CID135584981
Molecular FormulaC17H18N4O
Molecular Weight294.36 g/mol
Exact Mass294.15
IUPAC Name2-amino-6-(2-hydroxyphenyl)-4-piperidin-4-ylpyridine-3-carbonitrile
SMILESN#Cc1c(C2CCNCC2)cc(-c2ccccc2O)nc1N
InChIInChI=1S/C17H18N4O/c18-10-14-13(11-5-7-20-8-6-11)9-15(21-17(14)19)12-3-1-2-4-16(12)22/h1-4,9,11,20,22H,5-8H2,(H2,19,21)
InChIKeyMTGPCCDPOBAGGW-UHFFFAOYSA-N
XLogP2.38
TPSA94.96 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.36
LogP ≤ 52.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-Amino-6-(2-(cyclopropylmethoxy)-6-hydroxyphenyl)-4-piperidin-4-yl nicotinonitrile
CID 135465539
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
1-[[(6-Methylpyridin-2-yl)amino]methyl]naphthalen-2-ol
CID 890186
4-Methyl-2-[[(6-methylpyridin-2-yl)amino]methyl]phenol
CID 890931
5-Pyrimidinecarbonitrile, 4-amino-2-(2,5-dihydroxyphenyl)-6-(3-piperidinyl)-
CID 135427928
2-Amino-6-(2-hydroxyphenyl)-4-(piperidin-3-yl)nicotinonitrile
CID 135432858
2-Amino-6-[2-(cyclobutylmethoxy)-6-hydroxyphenyl]-4-piperidin-4-ylpyridine-3-carbonitrile
CID 135443473
2-Amino-6-[2-(cyclobutylmethoxy)-6-hydroxyphenyl]-4-piperidin-3-ylpyridine-3-carbonitrile
CID 135443474
N-{3-[2-Amino-3-cyano-6-(2-hydroxyphenyl)pyridin-4-yl]phenyl}-3-(piperidin-1-yl)propanamide
CID 135456003
2-Amino-6-[2-(cyclopropylmethoxy)-6-hydroxyphenyl]-4-piperidin-3-ylpyridine-3-carbonitrile
CID 135458385
2-Amino-6-(2-hydroxy-6-phenylmethoxyphenyl)-4-piperidin-3-ylpyridine-3-carbonitrile
CID 135469484

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-(2-hydroxyphenyl)-4-piperidin-4-ylpyridine-3-carbonitrile?
The IUPAC name of 2-amino-6-(2-hydroxyphenyl)-4-piperidin-4-ylpyridine-3-carbonitrile (CID 135584981) is 2-amino-6-(2-hydroxyphenyl)-4-piperidin-4-ylpyridine-3-carbonitrile.
What is the SMILES notation for 2-amino-6-(2-hydroxyphenyl)-4-piperidin-4-ylpyridine-3-carbonitrile?
The canonical SMILES for 2-amino-6-(2-hydroxyphenyl)-4-piperidin-4-ylpyridine-3-carbonitrile is N#Cc1c(C2CCNCC2)cc(-c2ccccc2O)nc1N.
What is the InChIKey of 2-amino-6-(2-hydroxyphenyl)-4-piperidin-4-ylpyridine-3-carbonitrile?
The InChIKey is MTGPCCDPOBAGGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4O/c18-10-14-13(11-5-7-20-8-6-11)9-15(21-17(14)19)12-3-1-2-4-16(12)22/h1-4,9,11,20,22H,5-8H2,(H2,19,21).
What are the key properties of 2-amino-6-(2-hydroxyphenyl)-4-piperidin-4-ylpyridine-3-carbonitrile?
2-amino-6-(2-hydroxyphenyl)-4-piperidin-4-ylpyridine-3-carbonitrile has a molecular weight of 294.36 g/mol, XLogP of 2.38, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-(2-hydroxyphenyl)-4-piperidin-4-ylpyridine-3-carbonitrile is sourced from PubChem (CID 135584981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).