N-(3-hydroxyphenyl)-N-methylpyridine-4-carboxamide

C13H12N2O2 — CID 107735844

IUPACN-(3-hydroxyphenyl)-N-methylpyridine-4-carboxamide
SMILESCN(C(=O)c1ccncc1)c1cccc(O)c1
InChIInChI=1S/C13H12N2O2/c1-15(11-3-2-4-12(16)9-11)13(17)10-5-7-14-8-6-10/h2-9,16H,1H3
InChIKeyNEQMXTCQBTYGMO-UHFFFAOYSA-N
MW228.25 g/mol
LogP2.06
Rot. Bonds2

About N-(3-hydroxyphenyl)-N-methylpyridine-4-carboxamide

N-(3-hydroxyphenyl)-N-methylpyridine-4-carboxamide (PubChem CID 107735844) has the molecular formula C13H12N2O2 and a molecular weight of 228.25 g/mol. Its IUPAC name is N-(3-hydroxyphenyl)-N-methylpyridine-4-carboxamide.

Molecular Properties

Compound NameN-(3-hydroxyphenyl)-N-methylpyridine-4-carboxamide
PubChem CID107735844
Molecular FormulaC13H12N2O2
Molecular Weight228.25 g/mol
Exact Mass228.09
IUPAC NameN-(3-hydroxyphenyl)-N-methylpyridine-4-carboxamide
SMILESCN(C(=O)c1ccncc1)c1cccc(O)c1
InChIInChI=1S/C13H12N2O2/c1-15(11-3-2-4-12(16)9-11)13(17)10-5-7-14-8-6-10/h2-9,16H,1H3
InChIKeyNEQMXTCQBTYGMO-UHFFFAOYSA-N
XLogP2.06
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.25
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-hydroxyphenyl)-N,2-dimethylpyridine-4-carboxamide
CID 107735739
3,5-dihydroxy-N-(3-hydroxyphenyl)-N-methylbenzamide
CID 107735650
N-(3-hydroxyphenyl)-N-methyl-4-methylsulfanylbenzamide
CID 107736061
3,4-dihydroxy-N-(3-hydroxyphenyl)-N-methylbenzamide
CID 107735623
4-hydroxy-N-(3-hydroxyphenyl)-N,3-dimethylbenzamide
CID 107735629
3,4-difluoro-N-(3-hydroxyphenyl)-N-methylbenzamide
CID 107735801
6-fluoro-N-(3-hydroxyphenyl)-N-methylpyridine-3-carboxamide
CID 114009640
(3-hydroxyphenyl)-methylcarbamic acid
CID 20544632
N-[3-[benzoyl(methyl)amino]phenyl]-N-methylbenzamide
CID 59642334
N-(3-hydroxyphenyl)-N-methyl-1H-indazole-6-carboxamide
CID 107735897
3-hydroxy-N-(4-hydroxyphenyl)-N-methylbenzamide
CID 28739062
3-(difluoromethoxy)-N-(3-hydroxyphenyl)-N-methylbenzamide
CID 107735708

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxyphenyl)-N-methylpyridine-4-carboxamide?
The IUPAC name of N-(3-hydroxyphenyl)-N-methylpyridine-4-carboxamide (CID 107735844) is N-(3-hydroxyphenyl)-N-methylpyridine-4-carboxamide.
What is the SMILES notation for N-(3-hydroxyphenyl)-N-methylpyridine-4-carboxamide?
The canonical SMILES for N-(3-hydroxyphenyl)-N-methylpyridine-4-carboxamide is CN(C(=O)c1ccncc1)c1cccc(O)c1.
What is the InChIKey of N-(3-hydroxyphenyl)-N-methylpyridine-4-carboxamide?
The InChIKey is NEQMXTCQBTYGMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N2O2/c1-15(11-3-2-4-12(16)9-11)13(17)10-5-7-14-8-6-10/h2-9,16H,1H3.
What are the key properties of N-(3-hydroxyphenyl)-N-methylpyridine-4-carboxamide?
N-(3-hydroxyphenyl)-N-methylpyridine-4-carboxamide has a molecular weight of 228.25 g/mol, XLogP of 2.06, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxyphenyl)-N-methylpyridine-4-carboxamide is sourced from PubChem (CID 107735844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).