5-chloro-3-phenylmethoxy-1H-pyridin-2-one

C12H10ClNO2 — CID 70036977

IUPAC5-chloro-3-phenylmethoxy-1H-pyridin-2-one
SMILESO=c1[nH]cc(Cl)cc1OCc1ccccc1
InChIInChI=1S/C12H10ClNO2/c13-10-6-11(12(15)14-7-10)16-8-9-4-2-1-3-5-9/h1-7H,8H2,(H,14,15)
InChIKeyJQOUDNYLILRGDJ-UHFFFAOYSA-N
MW235.67 g/mol
LogP2.61
Rot. Bonds3

About 5-chloro-3-phenylmethoxy-1H-pyridin-2-one

5-chloro-3-phenylmethoxy-1H-pyridin-2-one (PubChem CID 70036977) has the molecular formula C12H10ClNO2 and a molecular weight of 235.67 g/mol. Its IUPAC name is 5-chloro-3-phenylmethoxy-1H-pyridin-2-one.

Molecular Properties

Compound Name5-chloro-3-phenylmethoxy-1H-pyridin-2-one
PubChem CID70036977
Molecular FormulaC12H10ClNO2
Molecular Weight235.67 g/mol
Exact Mass235.04
IUPAC Name5-chloro-3-phenylmethoxy-1H-pyridin-2-one
SMILESO=c1[nH]cc(Cl)cc1OCc1ccccc1
InChIInChI=1S/C12H10ClNO2/c13-10-6-11(12(15)14-7-10)16-8-9-4-2-1-3-5-9/h1-7H,8H2,(H,14,15)
InChIKeyJQOUDNYLILRGDJ-UHFFFAOYSA-N
XLogP2.61
TPSA42.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.67
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-chloro-3-phenylmethoxy-1H-pyridin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,5-bis(phenylmethoxy)-1H-pyridin-4-one
CID 54191068
6-chloro-4-phenylmethoxy-1H-indole
CID 170993763
benzyl 4-chloro-2-phenylmethoxybenzoate
CID 66989997
2-oxo-5-(2-phenylmethoxyphenyl)-1H-pyridine-3-carboxylic acid
CID 53224525
3-methyl-5-(4-phenylmethoxyphenyl)-1H-pyridin-2-one
CID 169490402
2-(difluoromethyl)-5-phenylmethoxy-1H-pyridin-4-one
CID 67282165
4-methylsulfanyl-5-phenylmethoxy-1H-pyridin-2-one
CID 166675925
2-(bromomethyl)-1,5-dichloro-3-phenylmethoxybenzene
CID 14225535
2,3,6,7,10,11-hexakis(phenylmethoxy)triphenylene
CID 11040205
5-chloro-7-phenylmethoxy-2,3-dihydro-1H-indole
CID 14849556
3-(2,4-dichloro-6-phenylmethoxyphenyl)propanal
CID 14225536
(4-chloro-3-phenylmethoxyphenyl)methanol
CID 66724752

Frequently Asked Questions

What is the IUPAC name of 5-chloro-3-phenylmethoxy-1H-pyridin-2-one?
The IUPAC name of 5-chloro-3-phenylmethoxy-1H-pyridin-2-one (CID 70036977) is 5-chloro-3-phenylmethoxy-1H-pyridin-2-one.
What is the SMILES notation for 5-chloro-3-phenylmethoxy-1H-pyridin-2-one?
The canonical SMILES for 5-chloro-3-phenylmethoxy-1H-pyridin-2-one is O=c1[nH]cc(Cl)cc1OCc1ccccc1.
What is the InChIKey of 5-chloro-3-phenylmethoxy-1H-pyridin-2-one?
The InChIKey is JQOUDNYLILRGDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10ClNO2/c13-10-6-11(12(15)14-7-10)16-8-9-4-2-1-3-5-9/h1-7H,8H2,(H,14,15).
What are the key properties of 5-chloro-3-phenylmethoxy-1H-pyridin-2-one?
5-chloro-3-phenylmethoxy-1H-pyridin-2-one has a molecular weight of 235.67 g/mol, XLogP of 2.61, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-3-phenylmethoxy-1H-pyridin-2-one is sourced from PubChem (CID 70036977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).