N-[2-(2-oxopyrrolidin-1-yl)phenyl]cyclopropanecarboxamide

C14H16N2O2 — CID 18166596

IUPACN-[2-(2-oxopyrrolidin-1-yl)phenyl]cyclopropanecarboxamide
SMILESO=C(Nc1ccccc1N1CCCC1=O)C1CC1
InChIInChI=1S/C14H16N2O2/c17-13-6-3-9-16(13)12-5-2-1-4-11(12)15-14(18)10-7-8-10/h1-2,4-5,10H,3,6-9H2,(H,15,18)
InChIKeyGHOGCKUMXAUDSG-UHFFFAOYSA-N
MW244.29 g/mol
LogP2.16
Rot. Bonds3

About N-[2-(2-oxopyrrolidin-1-yl)phenyl]cyclopropanecarboxamide

N-[2-(2-oxopyrrolidin-1-yl)phenyl]cyclopropanecarboxamide (PubChem CID 18166596) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is N-[2-(2-oxopyrrolidin-1-yl)phenyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[2-(2-oxopyrrolidin-1-yl)phenyl]cyclopropanecarboxamide
PubChem CID18166596
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC NameN-[2-(2-oxopyrrolidin-1-yl)phenyl]cyclopropanecarboxamide
SMILESO=C(Nc1ccccc1N1CCCC1=O)C1CC1
InChIInChI=1S/C14H16N2O2/c17-13-6-3-9-16(13)12-5-2-1-4-11(12)15-14(18)10-7-8-10/h1-2,4-5,10H,3,6-9H2,(H,15,18)
InChIKeyGHOGCKUMXAUDSG-UHFFFAOYSA-N
XLogP2.16
TPSA49.41 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 ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2-oxopyrrolidin-1-yl)phenyl]cyclopropanecarboxamide?
The IUPAC name of N-[2-(2-oxopyrrolidin-1-yl)phenyl]cyclopropanecarboxamide (CID 18166596) is N-[2-(2-oxopyrrolidin-1-yl)phenyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[2-(2-oxopyrrolidin-1-yl)phenyl]cyclopropanecarboxamide?
The canonical SMILES for N-[2-(2-oxopyrrolidin-1-yl)phenyl]cyclopropanecarboxamide is O=C(Nc1ccccc1N1CCCC1=O)C1CC1.
What is the InChIKey of N-[2-(2-oxopyrrolidin-1-yl)phenyl]cyclopropanecarboxamide?
The InChIKey is GHOGCKUMXAUDSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c17-13-6-3-9-16(13)12-5-2-1-4-11(12)15-14(18)10-7-8-10/h1-2,4-5,10H,3,6-9H2,(H,15,18).
What are the key properties of N-[2-(2-oxopyrrolidin-1-yl)phenyl]cyclopropanecarboxamide?
N-[2-(2-oxopyrrolidin-1-yl)phenyl]cyclopropanecarboxamide has a molecular weight of 244.29 g/mol, XLogP of 2.16, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-oxopyrrolidin-1-yl)phenyl]cyclopropanecarboxamide is sourced from PubChem (CID 18166596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).