N-[4-(2-oxopyrrolidin-1-yl)phenyl]-1-phenylcyclopropane-1-carboxamide

C20H20N2O2 — CID 16764862

IUPACN-[4-(2-oxopyrrolidin-1-yl)phenyl]-1-phenylcyclopropane-1-carboxamide
SMILESO=C1CCCN1c1ccc(NC(=O)C2(c3ccccc3)CC2)cc1
InChIInChI=1S/C20H20N2O2/c23-18-7-4-14-22(18)17-10-8-16(9-11-17)21-19(24)20(12-13-20)15-5-2-1-3-6-15/h1-3,5-6,8-11H,4,7,12-14H2,(H,21,24)
InChIKeyOBZVYLSQWOJJPM-UHFFFAOYSA-N
MW320.39 g/mol
LogP3.48
Rot. Bonds4

About N-[4-(2-oxopyrrolidin-1-yl)phenyl]-1-phenylcyclopropane-1-carboxamide

N-[4-(2-oxopyrrolidin-1-yl)phenyl]-1-phenylcyclopropane-1-carboxamide (PubChem CID 16764862) has the molecular formula C20H20N2O2 and a molecular weight of 320.39 g/mol. Its IUPAC name is N-[4-(2-oxopyrrolidin-1-yl)phenyl]-1-phenylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-[4-(2-oxopyrrolidin-1-yl)phenyl]-1-phenylcyclopropane-1-carboxamide
PubChem CID16764862
Molecular FormulaC20H20N2O2
Molecular Weight320.39 g/mol
Exact Mass320.15
IUPAC NameN-[4-(2-oxopyrrolidin-1-yl)phenyl]-1-phenylcyclopropane-1-carboxamide
SMILESO=C1CCCN1c1ccc(NC(=O)C2(c3ccccc3)CC2)cc1
InChIInChI=1S/C20H20N2O2/c23-18-7-4-14-22(18)17-10-8-16(9-11-17)21-19(24)20(12-13-20)15-5-2-1-3-6-15/h1-3,5-6,8-11H,4,7,12-14H2,(H,21,24)
InChIKeyOBZVYLSQWOJJPM-UHFFFAOYSA-N
XLogP3.48
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.39
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[4-(2-oxopyrrolidin-1-yl)phenyl]-1-phenylcyclopropane-1-carboxamide?
The IUPAC name of N-[4-(2-oxopyrrolidin-1-yl)phenyl]-1-phenylcyclopropane-1-carboxamide (CID 16764862) is N-[4-(2-oxopyrrolidin-1-yl)phenyl]-1-phenylcyclopropane-1-carboxamide.
What is the SMILES notation for N-[4-(2-oxopyrrolidin-1-yl)phenyl]-1-phenylcyclopropane-1-carboxamide?
The canonical SMILES for N-[4-(2-oxopyrrolidin-1-yl)phenyl]-1-phenylcyclopropane-1-carboxamide is O=C1CCCN1c1ccc(NC(=O)C2(c3ccccc3)CC2)cc1.
What is the InChIKey of N-[4-(2-oxopyrrolidin-1-yl)phenyl]-1-phenylcyclopropane-1-carboxamide?
The InChIKey is OBZVYLSQWOJJPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O2/c23-18-7-4-14-22(18)17-10-8-16(9-11-17)21-19(24)20(12-13-20)15-5-2-1-3-6-15/h1-3,5-6,8-11H,4,7,12-14H2,(H,21,24).
What are the key properties of N-[4-(2-oxopyrrolidin-1-yl)phenyl]-1-phenylcyclopropane-1-carboxamide?
N-[4-(2-oxopyrrolidin-1-yl)phenyl]-1-phenylcyclopropane-1-carboxamide has a molecular weight of 320.39 g/mol, XLogP of 3.48, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-oxopyrrolidin-1-yl)phenyl]-1-phenylcyclopropane-1-carboxamide is sourced from PubChem (CID 16764862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).