N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-5-hydroxypentanamide

C15H19ClN2O3 — CID 79194755

IUPACN-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-5-hydroxypentanamide
SMILESO=C(CCCCO)Nc1ccc(N2CCCC2=O)c(Cl)c1
InChIInChI=1S/C15H19ClN2O3/c16-12-10-11(17-14(20)4-1-2-9-19)6-7-13(12)18-8-3-5-15(18)21/h6-7,10,19H,1-5,8-9H2,(H,17,20)
InChIKeyOORUSKUMDSMZQS-UHFFFAOYSA-N
MW310.78 g/mol
LogP2.57
Rot. Bonds6

About N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-5-hydroxypentanamide

N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-5-hydroxypentanamide (PubChem CID 79194755) has the molecular formula C15H19ClN2O3 and a molecular weight of 310.78 g/mol. Its IUPAC name is N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-5-hydroxypentanamide.

Molecular Properties

Compound NameN-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-5-hydroxypentanamide
PubChem CID79194755
Molecular FormulaC15H19ClN2O3
Molecular Weight310.78 g/mol
Exact Mass310.11
IUPAC NameN-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-5-hydroxypentanamide
SMILESO=C(CCCCO)Nc1ccc(N2CCCC2=O)c(Cl)c1
InChIInChI=1S/C15H19ClN2O3/c16-12-10-11(17-14(20)4-1-2-9-19)6-7-13(12)18-8-3-5-15(18)21/h6-7,10,19H,1-5,8-9H2,(H,17,20)
InChIKeyOORUSKUMDSMZQS-UHFFFAOYSA-N
XLogP2.57
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.78
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

5-chloro-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]pentanamide
CID 43347098
N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-4-oxo-4-thiophen-2-ylbutanamide
CID 46699704
N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-2-(2,5-dichlorophenoxy)acetamide
CID 24600272
N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-2-thiophen-2-ylacetamide
CID 17443162
1-[2-chloro-4-(methylamino)phenyl]pyrrolidin-2-one
CID 63090019
N-[2-[3-chloro-4-(2-oxopyrrolidin-1-yl)anilino]-2-oxoethyl]-2,4-difluorobenzamide
CID 46540627
N-(2,3-dihydro-1H-inden-5-yl)-5-hydroxypentanamide
CID 79199175
2-[(4-acetylphenyl)sulfonyl-methylamino]-N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 30601405
5-bromo-N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-2-hydroxybenzamide
CID 25495530
N-[3-methoxy-4-(2-oxopyrrolidin-1-yl)phenyl]-4-(3-methyl-2,5-dioxoimidazolidin-1-yl)butanamide
CID 18281436
N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]quinoxaline-2-carboxamide
CID 17452256
N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]acetamide
CID 24600255

Frequently Asked Questions

What is the IUPAC name of N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-5-hydroxypentanamide?
The IUPAC name of N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-5-hydroxypentanamide (CID 79194755) is N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-5-hydroxypentanamide.
What is the SMILES notation for N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-5-hydroxypentanamide?
The canonical SMILES for N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-5-hydroxypentanamide is O=C(CCCCO)Nc1ccc(N2CCCC2=O)c(Cl)c1.
What is the InChIKey of N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-5-hydroxypentanamide?
The InChIKey is OORUSKUMDSMZQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19ClN2O3/c16-12-10-11(17-14(20)4-1-2-9-19)6-7-13(12)18-8-3-5-15(18)21/h6-7,10,19H,1-5,8-9H2,(H,17,20).
What are the key properties of N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-5-hydroxypentanamide?
N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-5-hydroxypentanamide has a molecular weight of 310.78 g/mol, XLogP of 2.57, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-5-hydroxypentanamide is sourced from PubChem (CID 79194755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).