1-(cyclopropylmethoxy)-4-hydroxyquinolin-2-one

C13H13NO3 — CID 172706207

IUPAC1-(cyclopropylmethoxy)-4-hydroxyquinolin-2-one
SMILESO=c1cc(O)c2ccccc2n1OCC1CC1
InChIInChI=1S/C13H13NO3/c15-12-7-13(16)14(17-8-9-5-6-9)11-4-2-1-3-10(11)12/h1-4,7,9,15H,5-6,8H2
InChIKeyDPUYGMDNCJMCLV-UHFFFAOYSA-N
MW231.25 g/mol
LogP1.55
Rot. Bonds3

About 1-(cyclopropylmethoxy)-4-hydroxyquinolin-2-one

1-(cyclopropylmethoxy)-4-hydroxyquinolin-2-one (PubChem CID 172706207) has the molecular formula C13H13NO3 and a molecular weight of 231.25 g/mol. Its IUPAC name is 1-(cyclopropylmethoxy)-4-hydroxyquinolin-2-one.

Molecular Properties

Compound Name1-(cyclopropylmethoxy)-4-hydroxyquinolin-2-one
PubChem CID172706207
Molecular FormulaC13H13NO3
Molecular Weight231.25 g/mol
Exact Mass231.09
IUPAC Name1-(cyclopropylmethoxy)-4-hydroxyquinolin-2-one
SMILESO=c1cc(O)c2ccccc2n1OCC1CC1
InChIInChI=1S/C13H13NO3/c15-12-7-13(16)14(17-8-9-5-6-9)11-4-2-1-3-10(11)12/h1-4,7,9,15H,5-6,8H2
InChIKeyDPUYGMDNCJMCLV-UHFFFAOYSA-N
XLogP1.55
TPSA51.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.25
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(cyclopropylmethoxy)-4-hydroxyquinolin-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

4-hydroxy-1-[(4-methoxyphenyl)methoxy]quinolin-2-one
CID 172846173
(2S)-2-[cyclopropylmethoxy-(4-hydroxy-2-oxoquinoline-1-carbonyl)amino]propanoic acid
CID 90258294
4-hydroxy-1-(2-hydroxyethyl)quinolin-2-one
CID 54738067
1-cyclohexyl-4-hydroxyquinolin-2-one
CID 54723672
1-[(2-chlorophenyl)methyl]-4-hydroxyquinolin-2-one
CID 54679720
1-(cyclobutylamino)-4-hydroxyquinolin-2-one;1-(cyclobutylideneamino)-4-hydroxyquinolin-2-one
CID 161190977
1-(cyclopropylmethoxy)benzimidazole
CID 67806011
4-hydroxy-1-[2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]quinolin-2-one
CID 54724425
2-chloro-1-(cyclopropylmethoxy)indole-6-carboxylic acid
CID 69216276
2-(cyclopropylmethyl)phenol
CID 23014132
4-(cyclopropylmethoxy)-2,5-diphenylbenzene-1,3-diol
CID 44577292
(4-hydroxycyclohexyl)methyl 1-methylindole-3-carboxylate
CID 140552406

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylmethoxy)-4-hydroxyquinolin-2-one?
The IUPAC name of 1-(cyclopropylmethoxy)-4-hydroxyquinolin-2-one (CID 172706207) is 1-(cyclopropylmethoxy)-4-hydroxyquinolin-2-one.
What is the SMILES notation for 1-(cyclopropylmethoxy)-4-hydroxyquinolin-2-one?
The canonical SMILES for 1-(cyclopropylmethoxy)-4-hydroxyquinolin-2-one is O=c1cc(O)c2ccccc2n1OCC1CC1.
What is the InChIKey of 1-(cyclopropylmethoxy)-4-hydroxyquinolin-2-one?
The InChIKey is DPUYGMDNCJMCLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NO3/c15-12-7-13(16)14(17-8-9-5-6-9)11-4-2-1-3-10(11)12/h1-4,7,9,15H,5-6,8H2.
What are the key properties of 1-(cyclopropylmethoxy)-4-hydroxyquinolin-2-one?
1-(cyclopropylmethoxy)-4-hydroxyquinolin-2-one has a molecular weight of 231.25 g/mol, XLogP of 1.55, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylmethoxy)-4-hydroxyquinolin-2-one is sourced from PubChem (CID 172706207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).