1-(2-cyclopropylphenyl)-5-oxopyrrolidine-3-carboxamide

C14H16N2O2 — CID 168698149

IUPAC1-(2-cyclopropylphenyl)-5-oxopyrrolidine-3-carboxamide
SMILESNC(=O)C1CC(=O)N(c2ccccc2C2CC2)C1
InChIInChI=1S/C14H16N2O2/c15-14(18)10-7-13(17)16(8-10)12-4-2-1-3-11(12)9-5-6-9/h1-4,9-10H,5-8H2,(H2,15,18)
InChIKeyIKFCMGAMEUMTLW-UHFFFAOYSA-N
MW244.29 g/mol
LogP1.40
Rot. Bonds3

About 1-(2-cyclopropylphenyl)-5-oxopyrrolidine-3-carboxamide

1-(2-cyclopropylphenyl)-5-oxopyrrolidine-3-carboxamide (PubChem CID 168698149) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is 1-(2-cyclopropylphenyl)-5-oxopyrrolidine-3-carboxamide.

Molecular Properties

Compound Name1-(2-cyclopropylphenyl)-5-oxopyrrolidine-3-carboxamide
PubChem CID168698149
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC Name1-(2-cyclopropylphenyl)-5-oxopyrrolidine-3-carboxamide
SMILESNC(=O)C1CC(=O)N(c2ccccc2C2CC2)C1
InChIInChI=1S/C14H16N2O2/c15-14(18)10-7-13(17)16(8-10)12-4-2-1-3-11(12)9-5-6-9/h1-4,9-10H,5-8H2,(H2,15,18)
InChIKeyIKFCMGAMEUMTLW-UHFFFAOYSA-N
XLogP1.40
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3S)-1-(2-chlorophenyl)-5-oxopyrrolidine-3-carboxamide
CID 42579807
1-[2-(aminomethyl)phenyl]-5-oxopyrrolidine-3-carboxamide
CID 168697394
1-(2-methylsulfonylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 168696654
1-[(3R)-1-(2-chlorophenyl)-5-oxopyrrolidine-3-carbonyl]piperidine-4-carboxamide
CID 32978569
1-(2,3-difluorophenyl)-5-oxopyrrolidine-3-carboxamide
CID 168698402
1-[2-(4-acetylpiperazin-1-yl)phenyl]-5-oxopyrrolidine-3-carboxamide
CID 50882349
5-oxo-1-[2-(propan-2-ylcarbamoyl)phenyl]pyrrolidine-3-carboxamide
CID 168696074
1-(2-bromo-3-pyridinyl)-5-oxopyrrolidine-3-carboxamide
CID 168698437
[1-(2-cyclopropylphenyl)-5-oxopyrrolidin-3-yl]methanesulfonamide
CID 168682896
(3R)-1-[2-(4-methylsulfonylpiperazin-1-yl)phenyl]-5-oxopyrrolidine-3-carboxamide
CID 94671849
(3S)-1-[3-[(4R)-4-carbamoyl-2-oxopyrrolidin-1-yl]phenyl]-5-oxopyrrolidine-3-carboxamide
CID 94076238
5-oxo-1-(1-oxo-3H-2-benzofuran-4-yl)pyrrolidine-3-carboxamide
CID 168698429

Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclopropylphenyl)-5-oxopyrrolidine-3-carboxamide?
The IUPAC name of 1-(2-cyclopropylphenyl)-5-oxopyrrolidine-3-carboxamide (CID 168698149) is 1-(2-cyclopropylphenyl)-5-oxopyrrolidine-3-carboxamide.
What is the SMILES notation for 1-(2-cyclopropylphenyl)-5-oxopyrrolidine-3-carboxamide?
The canonical SMILES for 1-(2-cyclopropylphenyl)-5-oxopyrrolidine-3-carboxamide is NC(=O)C1CC(=O)N(c2ccccc2C2CC2)C1.
What is the InChIKey of 1-(2-cyclopropylphenyl)-5-oxopyrrolidine-3-carboxamide?
The InChIKey is IKFCMGAMEUMTLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c15-14(18)10-7-13(17)16(8-10)12-4-2-1-3-11(12)9-5-6-9/h1-4,9-10H,5-8H2,(H2,15,18).
What are the key properties of 1-(2-cyclopropylphenyl)-5-oxopyrrolidine-3-carboxamide?
1-(2-cyclopropylphenyl)-5-oxopyrrolidine-3-carboxamide has a molecular weight of 244.29 g/mol, XLogP of 1.40, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclopropylphenyl)-5-oxopyrrolidine-3-carboxamide is sourced from PubChem (CID 168698149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).