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

C14H16N2O2 — CID 7686385

IUPACN-[4-(2-oxopyrrolidin-1-yl)phenyl]cyclopropanecarboxamide
SMILESO=C(Nc1ccc(N2CCCC2=O)cc1)C1CC1
InChIInChI=1S/C14H16N2O2/c17-13-2-1-9-16(13)12-7-5-11(6-8-12)15-14(18)10-3-4-10/h5-8,10H,1-4,9H2,(H,15,18)
InChIKeyDUYGHCDQGWNTOE-UHFFFAOYSA-N
MW244.29 g/mol
LogP2.16
Rot. Bonds3

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

N-[4-(2-oxopyrrolidin-1-yl)phenyl]cyclopropanecarboxamide (PubChem CID 7686385) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is N-[4-(2-oxopyrrolidin-1-yl)phenyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[4-(2-oxopyrrolidin-1-yl)phenyl]cyclopropanecarboxamide
PubChem CID7686385
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC NameN-[4-(2-oxopyrrolidin-1-yl)phenyl]cyclopropanecarboxamide
SMILESO=C(Nc1ccc(N2CCCC2=O)cc1)C1CC1
InChIInChI=1S/C14H16N2O2/c17-13-2-1-9-16(13)12-7-5-11(6-8-12)15-14(18)10-3-4-10/h5-8,10H,1-4,9H2,(H,15,18)
InChIKeyDUYGHCDQGWNTOE-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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Related Compounds

tert-butyl 4-[[4-(2-oxopyrrolidin-1-yl)phenyl]carbamoyl]piperidine-1-carboxylate
CID 36570789
9-amino-N-[4-(2-oxopyrrolidin-1-yl)phenyl]bicyclo[3.3.1]nonane-3-carboxamide;hydrochloride
CID 120984328
2-N-[4-(2-oxopyrrolidin-1-yl)phenyl]cyclobutane-1,2-dicarboxamide
CID 167890277
N-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 7686436
N-[4-(2-oxopyrrolidin-1-yl)phenyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide
CID 9361387
N-[4-(2-oxopyrrolidin-1-yl)phenyl]piperidine-2-carboxamide;hydrochloride
CID 119270698
N-[4-[1-[[(E)-3-[4-(2-oxopyrrolidin-1-yl)phenyl]prop-2-enoyl]amino]ethyl]phenyl]cyclopropanecarboxamide
CID 46595098
1-[1-(cyclopropanecarbonyl)piperidin-4-yl]-3-[4-(2-oxopyrrolidin-1-yl)phenyl]urea
CID 128930624
N-cyclopentyl-N'-[4-(2-oxopyrrolidin-1-yl)phenyl]oxamide
CID 30679166
N-[3-(2-oxopiperidin-1-yl)phenyl]cyclopentanecarboxamide
CID 7687609
N-[2-[3-(cyclopropanecarbonylamino)anilino]-2-oxoethyl]-4-(2-oxopyrrolidin-1-yl)benzamide
CID 46584847
(1R,2S,3R,4R)-3-[[4-(2-oxopyrrolidin-1-yl)phenyl]carbamoyl]bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
CID 98336597

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-oxopyrrolidin-1-yl)phenyl]cyclopropanecarboxamide?
The IUPAC name of N-[4-(2-oxopyrrolidin-1-yl)phenyl]cyclopropanecarboxamide (CID 7686385) is N-[4-(2-oxopyrrolidin-1-yl)phenyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[4-(2-oxopyrrolidin-1-yl)phenyl]cyclopropanecarboxamide?
The canonical SMILES for N-[4-(2-oxopyrrolidin-1-yl)phenyl]cyclopropanecarboxamide is O=C(Nc1ccc(N2CCCC2=O)cc1)C1CC1.
What is the InChIKey of N-[4-(2-oxopyrrolidin-1-yl)phenyl]cyclopropanecarboxamide?
The InChIKey is DUYGHCDQGWNTOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c17-13-2-1-9-16(13)12-7-5-11(6-8-12)15-14(18)10-3-4-10/h5-8,10H,1-4,9H2,(H,15,18).
What are the key properties of N-[4-(2-oxopyrrolidin-1-yl)phenyl]cyclopropanecarboxamide?
N-[4-(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-[4-(2-oxopyrrolidin-1-yl)phenyl]cyclopropanecarboxamide is sourced from PubChem (CID 7686385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).