5-(4-methoxyanilino)-1H-pyridin-2-one

C12H12N2O2 — CID 175774700

IUPAC5-(4-methoxyanilino)-1H-pyridin-2-one
SMILESCOc1ccc(Nc2ccc(=O)[nH]c2)cc1
InChIInChI=1S/C12H12N2O2/c1-16-11-5-2-9(3-6-11)14-10-4-7-12(15)13-8-10/h2-8,14H,1H3,(H,13,15)
InChIKeyKCDNXBYSINTSDT-UHFFFAOYSA-N
MW216.24 g/mol
LogP2.13
Rot. Bonds3

About 5-(4-methoxyanilino)-1H-pyridin-2-one

5-(4-methoxyanilino)-1H-pyridin-2-one (PubChem CID 175774700) has the molecular formula C12H12N2O2 and a molecular weight of 216.24 g/mol. Its IUPAC name is 5-(4-methoxyanilino)-1H-pyridin-2-one.

Molecular Properties

Compound Name5-(4-methoxyanilino)-1H-pyridin-2-one
PubChem CID175774700
Molecular FormulaC12H12N2O2
Molecular Weight216.24 g/mol
Exact Mass216.09
IUPAC Name5-(4-methoxyanilino)-1H-pyridin-2-one
SMILESCOc1ccc(Nc2ccc(=O)[nH]c2)cc1
InChIInChI=1S/C12H12N2O2/c1-16-11-5-2-9(3-6-11)14-10-4-7-12(15)13-8-10/h2-8,14H,1H3,(H,13,15)
InChIKeyKCDNXBYSINTSDT-UHFFFAOYSA-N
XLogP2.13
TPSA54.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.24
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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5-(6-methoxynaphthalen-2-yl)-1H-pyridin-2-one
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5-(methylamino)-1H-pyridin-2-one;hydrochloride
CID 170916863
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CID 82535713
N-(4-methoxyphenyl)-4-phenylaniline
CID 57004376
3-bromo-4-(4-methoxyanilino)pyrrole-2,5-dione
CID 146673844
2,3,5-trichloro-6-(4-methoxyanilino)cyclohexa-2,5-diene-1,4-dione
CID 12620326
dimethyl 5-(4-methoxyanilino)benzene-1,3-dicarboxylate
CID 155291103
methyl 2-[4-(4-methoxyanilino)phenyl]acetate
CID 82535736
3,4,5-trifluoro-N-(4-methoxyphenyl)aniline
CID 52951070

Frequently Asked Questions

What is the IUPAC name of 5-(4-methoxyanilino)-1H-pyridin-2-one?
The IUPAC name of 5-(4-methoxyanilino)-1H-pyridin-2-one (CID 175774700) is 5-(4-methoxyanilino)-1H-pyridin-2-one.
What is the SMILES notation for 5-(4-methoxyanilino)-1H-pyridin-2-one?
The canonical SMILES for 5-(4-methoxyanilino)-1H-pyridin-2-one is COc1ccc(Nc2ccc(=O)[nH]c2)cc1.
What is the InChIKey of 5-(4-methoxyanilino)-1H-pyridin-2-one?
The InChIKey is KCDNXBYSINTSDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O2/c1-16-11-5-2-9(3-6-11)14-10-4-7-12(15)13-8-10/h2-8,14H,1H3,(H,13,15).
What are the key properties of 5-(4-methoxyanilino)-1H-pyridin-2-one?
5-(4-methoxyanilino)-1H-pyridin-2-one has a molecular weight of 216.24 g/mol, XLogP of 2.13, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methoxyanilino)-1H-pyridin-2-one is sourced from PubChem (CID 175774700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).