N-[4-(hydroxymethyl)phenyl]-2-pyridin-2-ylpyridine-4-carboxamide

C18H15N3O2 — CID 10193154

IUPACN-[4-(hydroxymethyl)phenyl]-2-pyridin-2-ylpyridine-4-carboxamide
SMILESO=C(Nc1ccc(CO)cc1)c1ccnc(-c2ccccn2)c1
InChIInChI=1S/C18H15N3O2/c22-12-13-4-6-15(7-5-13)21-18(23)14-8-10-20-17(11-14)16-3-1-2-9-19-16/h1-11,22H,12H2,(H,21,23)
InChIKeyKZUCGZMPJVDTIW-UHFFFAOYSA-N
MW305.34 g/mol
LogP2.89
Rot. Bonds4

About N-[4-(hydroxymethyl)phenyl]-2-pyridin-2-ylpyridine-4-carboxamide

N-[4-(hydroxymethyl)phenyl]-2-pyridin-2-ylpyridine-4-carboxamide (PubChem CID 10193154) has the molecular formula C18H15N3O2 and a molecular weight of 305.34 g/mol. Its IUPAC name is N-[4-(hydroxymethyl)phenyl]-2-pyridin-2-ylpyridine-4-carboxamide.

Molecular Properties

Compound NameN-[4-(hydroxymethyl)phenyl]-2-pyridin-2-ylpyridine-4-carboxamide
PubChem CID10193154
Molecular FormulaC18H15N3O2
Molecular Weight305.34 g/mol
Exact Mass305.12
IUPAC NameN-[4-(hydroxymethyl)phenyl]-2-pyridin-2-ylpyridine-4-carboxamide
SMILESO=C(Nc1ccc(CO)cc1)c1ccnc(-c2ccccn2)c1
InChIInChI=1S/C18H15N3O2/c22-12-13-4-6-15(7-5-13)21-18(23)14-8-10-20-17(11-14)16-3-1-2-9-19-16/h1-11,22H,12H2,(H,21,23)
InChIKeyKZUCGZMPJVDTIW-UHFFFAOYSA-N
XLogP2.89
TPSA75.11 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.34
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[[2-[4-[(4-carboxyphenyl)carbamoyl]-2-pyridinyl]pyridine-4-carbonyl]amino]benzoic acid
CID 102503336
N-(4-hydroxybutyl)-2-pyridin-2-ylpyridine-4-carboxamide
CID 10149325
3-bromo-N-[4-(hydroxymethyl)phenyl]benzamide
CID 64794650
2-pyridin-2-yl-N-[4-(10,15,20-triphenyl-21,23-dihydroporphyrin-5-yl)phenyl]pyridine-4-carboxamide
CID 136732190
2-pyridin-2-ylpyridine-4-carboxylic acid;dihydrochloride
CID 91928344
2-(4-carboxy-2-pyridinyl)pyridine-4-carboxylic acid;bis(2-pyridin-2-ylpyridine);ruthenium
CID 14951635
2-(4-carboxy-2-pyridinyl)pyridine-4-carboxylic acid;osmium;bis(2-pyridin-2-ylpyridine)
CID 162025014
N-[2-deuterio-4-(hydroxymethyl)phenyl]benzamide
CID 175908622
N-[4-(hydroxymethyl)phenyl]-3,4-dimethylbenzamide
CID 64793175
N-[4-(2-hydroxyethyl)phenyl]pyridine-2-carboxamide
CID 61223962
4-(aminomethyl)-N-(4-chloro-3-pyridin-2-ylphenyl)benzamide
CID 66877992
2-bromo-N-(4-ethylphenyl)pyridine-4-carboxamide
CID 113255068

Frequently Asked Questions

What is the IUPAC name of N-[4-(hydroxymethyl)phenyl]-2-pyridin-2-ylpyridine-4-carboxamide?
The IUPAC name of N-[4-(hydroxymethyl)phenyl]-2-pyridin-2-ylpyridine-4-carboxamide (CID 10193154) is N-[4-(hydroxymethyl)phenyl]-2-pyridin-2-ylpyridine-4-carboxamide.
What is the SMILES notation for N-[4-(hydroxymethyl)phenyl]-2-pyridin-2-ylpyridine-4-carboxamide?
The canonical SMILES for N-[4-(hydroxymethyl)phenyl]-2-pyridin-2-ylpyridine-4-carboxamide is O=C(Nc1ccc(CO)cc1)c1ccnc(-c2ccccn2)c1.
What is the InChIKey of N-[4-(hydroxymethyl)phenyl]-2-pyridin-2-ylpyridine-4-carboxamide?
The InChIKey is KZUCGZMPJVDTIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N3O2/c22-12-13-4-6-15(7-5-13)21-18(23)14-8-10-20-17(11-14)16-3-1-2-9-19-16/h1-11,22H,12H2,(H,21,23).
What are the key properties of N-[4-(hydroxymethyl)phenyl]-2-pyridin-2-ylpyridine-4-carboxamide?
N-[4-(hydroxymethyl)phenyl]-2-pyridin-2-ylpyridine-4-carboxamide has a molecular weight of 305.34 g/mol, XLogP of 2.89, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(hydroxymethyl)phenyl]-2-pyridin-2-ylpyridine-4-carboxamide is sourced from PubChem (CID 10193154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).