N-(2-aminophenyl)-5-cyano-N-(2-hydroxyethyl)pyridine-2-carboxamide

C15H14N4O2 — CID 63724012

IUPACN-(2-aminophenyl)-5-cyano-N-(2-hydroxyethyl)pyridine-2-carboxamide
SMILESN#Cc1ccc(C(=O)N(CCO)c2ccccc2N)nc1
InChIInChI=1S/C15H14N4O2/c16-9-11-5-6-13(18-10-11)15(21)19(7-8-20)14-4-2-1-3-12(14)17/h1-6,10,20H,7-8,17H2
InChIKeyHLVQNAPTZMTUNP-UHFFFAOYSA-N
MW282.30 g/mol
LogP1.17
Rot. Bonds4

About N-(2-aminophenyl)-5-cyano-N-(2-hydroxyethyl)pyridine-2-carboxamide

N-(2-aminophenyl)-5-cyano-N-(2-hydroxyethyl)pyridine-2-carboxamide (PubChem CID 63724012) has the molecular formula C15H14N4O2 and a molecular weight of 282.30 g/mol. Its IUPAC name is N-(2-aminophenyl)-5-cyano-N-(2-hydroxyethyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2-aminophenyl)-5-cyano-N-(2-hydroxyethyl)pyridine-2-carboxamide
PubChem CID63724012
Molecular FormulaC15H14N4O2
Molecular Weight282.30 g/mol
Exact Mass282.11
IUPAC NameN-(2-aminophenyl)-5-cyano-N-(2-hydroxyethyl)pyridine-2-carboxamide
SMILESN#Cc1ccc(C(=O)N(CCO)c2ccccc2N)nc1
InChIInChI=1S/C15H14N4O2/c16-9-11-5-6-13(18-10-11)15(21)19(7-8-20)14-4-2-1-3-12(14)17/h1-6,10,20H,7-8,17H2
InChIKeyHLVQNAPTZMTUNP-UHFFFAOYSA-N
XLogP1.17
TPSA103.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 51.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

5-cyano-N-(2-hydroxyethyl)-N-propylpyridine-2-carboxamide
CID 63724052
N-(3-aminophenyl)-5-cyano-N-propylpyridine-2-carboxamide
CID 63723674
N-(2-aminophenyl)-N-propylpyridine-2-carboxamide
CID 63230351
N-(2-amino-5-chlorophenyl)-5-cyano-N-methylpyridine-2-carboxamide
CID 107465551
5-cyano-N,N-bis(cyanomethyl)pyridine-2-carboxamide
CID 63718638
N-(2-aminophenyl)-N-(2-hydroxyethyl)-1,5-dimethylpyrazole-4-carboxamide
CID 43547822
5-cyano-N-ethyl-N-propylpyridine-2-carboxamide
CID 63717846
N-(2-aminophenyl)-3-bromo-N-(2-hydroxyethyl)pyridine-2-carboxamide
CID 107516864
N-(2-aminophenyl)-N-(2-hydroxyethyl)propanamide
CID 43547811
N-(2-aminophenyl)-2,6-dichloro-N-(2-hydroxyethyl)benzamide
CID 43547863
N-benzyl-5-cyano-N-[(2S)-4-hydroxybutan-2-yl]pyridine-2-carboxamide
CID 97061706
N-butyl-5-cyano-N-ethylpyridine-2-carboxamide
CID 63719310

Frequently Asked Questions

What is the IUPAC name of N-(2-aminophenyl)-5-cyano-N-(2-hydroxyethyl)pyridine-2-carboxamide?
The IUPAC name of N-(2-aminophenyl)-5-cyano-N-(2-hydroxyethyl)pyridine-2-carboxamide (CID 63724012) is N-(2-aminophenyl)-5-cyano-N-(2-hydroxyethyl)pyridine-2-carboxamide.
What is the SMILES notation for N-(2-aminophenyl)-5-cyano-N-(2-hydroxyethyl)pyridine-2-carboxamide?
The canonical SMILES for N-(2-aminophenyl)-5-cyano-N-(2-hydroxyethyl)pyridine-2-carboxamide is N#Cc1ccc(C(=O)N(CCO)c2ccccc2N)nc1.
What is the InChIKey of N-(2-aminophenyl)-5-cyano-N-(2-hydroxyethyl)pyridine-2-carboxamide?
The InChIKey is HLVQNAPTZMTUNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O2/c16-9-11-5-6-13(18-10-11)15(21)19(7-8-20)14-4-2-1-3-12(14)17/h1-6,10,20H,7-8,17H2.
What are the key properties of N-(2-aminophenyl)-5-cyano-N-(2-hydroxyethyl)pyridine-2-carboxamide?
N-(2-aminophenyl)-5-cyano-N-(2-hydroxyethyl)pyridine-2-carboxamide has a molecular weight of 282.30 g/mol, XLogP of 1.17, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminophenyl)-5-cyano-N-(2-hydroxyethyl)pyridine-2-carboxamide is sourced from PubChem (CID 63724012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).