1-(2H-chromen-4-yl)pyrrolidin-2-one

C13H13NO2 — CID 19937601

IUPAC1-(2H-chromen-4-yl)pyrrolidin-2-one
SMILESO=C1CCCN1C1=CCOc2ccccc21
InChIInChI=1S/C13H13NO2/c15-13-6-3-8-14(13)11-7-9-16-12-5-2-1-4-10(11)12/h1-2,4-5,7H,3,6,8-9H2
InChIKeyCPLSOHORKYOKHS-UHFFFAOYSA-N
MW215.25 g/mol
LogP2.04
Rot. Bonds1

About 1-(2H-chromen-4-yl)pyrrolidin-2-one

1-(2H-chromen-4-yl)pyrrolidin-2-one (PubChem CID 19937601) has the molecular formula C13H13NO2 and a molecular weight of 215.25 g/mol. Its IUPAC name is 1-(2H-chromen-4-yl)pyrrolidin-2-one.

Molecular Properties

Compound Name1-(2H-chromen-4-yl)pyrrolidin-2-one
PubChem CID19937601
Molecular FormulaC13H13NO2
Molecular Weight215.25 g/mol
Exact Mass215.09
IUPAC Name1-(2H-chromen-4-yl)pyrrolidin-2-one
SMILESO=C1CCCN1C1=CCOc2ccccc21
InChIInChI=1S/C13H13NO2/c15-13-6-3-8-14(13)11-7-9-16-12-5-2-1-4-10(11)12/h1-2,4-5,7H,3,6,8-9H2
InChIKeyCPLSOHORKYOKHS-UHFFFAOYSA-N
XLogP2.04
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.25
LogP ≤ 52.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-(2H-chromen-4-yl)pyrrolidin-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

1-(2,2-dimethyl-1H-quinolin-4-yl)pyrrolidin-2-one
CID 154335214
1-[4-(2-oxopyrrolidin-1-yl)phenyl]pyrrolidin-2-one
CID 822790
1-(2-hydroxyphenyl)pyrrolidin-2-one
CID 695303
1-(cyclopropen-1-yl)pyrrolidin-2-one
CID 147715562
1-[2,5-bis(2-tert-butylphenyl)-4-(2-oxopyrrolidin-1-yl)phenyl]pyrrolidin-2-one
CID 172517282
1-[3-[4-tert-butyl-2,6-bis[2-(trifluoromethyl)phenyl]phenyl]-5-(2-oxopyrrolidin-1-yl)phenyl]pyrrolidin-2-one
CID 176828076
1-[2-[2,5-dideuterio-4-[2-(2-oxopyrrolidin-1-yl)phenyl]-3,6-bis[2-(trifluoromethyl)phenyl]phenyl]phenyl]pyrrolidin-2-one
CID 176589252
4-phenyl-2H-chromene
CID 11063647
1-(2-oxopyrrolidin-1-yl)-3,4-dihydronaphthalene-2-carbaldehyde
CID 102088796
2-(2H-chromen-4-yl)-2-oxoacetic acid
CID 175857697
2-oxabicyclo[9.4.0]pentadeca-1(15),11,13-trien-10-one
CID 72551303
1-[6-hydroxy-3-(2-hydroxyphenyl)-2-methylphenyl]pyrrolidin-2-one
CID 70372340

Frequently Asked Questions

What is the IUPAC name of 1-(2H-chromen-4-yl)pyrrolidin-2-one?
The IUPAC name of 1-(2H-chromen-4-yl)pyrrolidin-2-one (CID 19937601) is 1-(2H-chromen-4-yl)pyrrolidin-2-one.
What is the SMILES notation for 1-(2H-chromen-4-yl)pyrrolidin-2-one?
The canonical SMILES for 1-(2H-chromen-4-yl)pyrrolidin-2-one is O=C1CCCN1C1=CCOc2ccccc21.
What is the InChIKey of 1-(2H-chromen-4-yl)pyrrolidin-2-one?
The InChIKey is CPLSOHORKYOKHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NO2/c15-13-6-3-8-14(13)11-7-9-16-12-5-2-1-4-10(11)12/h1-2,4-5,7H,3,6,8-9H2.
What are the key properties of 1-(2H-chromen-4-yl)pyrrolidin-2-one?
1-(2H-chromen-4-yl)pyrrolidin-2-one has a molecular weight of 215.25 g/mol, XLogP of 2.04, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2H-chromen-4-yl)pyrrolidin-2-one is sourced from PubChem (CID 19937601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).