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

C18H18N4O3 — CID 26127679

IUPAC4-(carbamoylamino)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
SMILESNC(=O)Nc1ccc(C(=O)Nc2ccc(N3CCCC3=O)cc2)cc1
InChIInChI=1S/C18H18N4O3/c19-18(25)21-14-5-3-12(4-6-14)17(24)20-13-7-9-15(10-8-13)22-11-1-2-16(22)23/h3-10H,1-2,11H2,(H,20,24)(H3,19,21,25)
InChIKeyKNENLTPQIZWHAY-UHFFFAOYSA-N
MW338.37 g/mol
LogP2.56
Rot. Bonds4

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

4-(carbamoylamino)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide (PubChem CID 26127679) has the molecular formula C18H18N4O3 and a molecular weight of 338.37 g/mol. Its IUPAC name is 4-(carbamoylamino)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide.

Molecular Properties

Compound Name4-(carbamoylamino)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
PubChem CID26127679
Molecular FormulaC18H18N4O3
Molecular Weight338.37 g/mol
Exact Mass338.14
IUPAC Name4-(carbamoylamino)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
SMILESNC(=O)Nc1ccc(C(=O)Nc2ccc(N3CCCC3=O)cc2)cc1
InChIInChI=1S/C18H18N4O3/c19-18(25)21-14-5-3-12(4-6-14)17(24)20-13-7-9-15(10-8-13)22-11-1-2-16(22)23/h3-10H,1-2,11H2,(H,20,24)(H3,19,21,25)
InChIKeyKNENLTPQIZWHAY-UHFFFAOYSA-N
XLogP2.56
TPSA104.53 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.37
LogP ≤ 52.56
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-acetamido-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 78788340
4-(2-oxopyrrolidin-1-yl)-N-(4-piperidin-1-ylphenyl)benzamide
CID 7922377
methyl 4-[[4-(2-oxopyrrolidin-1-yl)phenyl]carbamoyl]benzoate
CID 8747295
N-(4-methoxyphenyl)-4-(2-oxopyrrolidin-1-yl)benzamide
CID 9412020
N-[4-(2-methylpropanoylamino)phenyl]-4-(2-oxopyrrolidin-1-yl)benzamide
CID 26680013
N-(4-chlorophenyl)-4-(2-oxopiperidin-1-yl)benzamide
CID 36678322
N-(4-acetylphenyl)-4-(2-oxopiperidin-1-yl)benzamide
CID 9242933
4-(benzenesulfonamido)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 28578210
N-[4-(cyanomethyl)phenyl]-4-(2-oxopyrrolidin-1-yl)benzamide
CID 9260210
N-[4-(difluoromethylsulfanyl)phenyl]-4-(2-oxopyrrolidin-1-yl)benzamide
CID 26908369
N-[4-[[4-(2-oxopyrrolidin-1-yl)phenyl]carbamoyl]phenyl]furan-2-carboxamide
CID 9371428
N-[4-(4-ethylpiperazin-1-yl)phenyl]-4-(2-oxopyrrolidin-1-yl)benzamide
CID 42239391

Frequently Asked Questions

What is the IUPAC name of 4-(carbamoylamino)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide?
The IUPAC name of 4-(carbamoylamino)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide (CID 26127679) is 4-(carbamoylamino)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide.
What is the SMILES notation for 4-(carbamoylamino)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide?
The canonical SMILES for 4-(carbamoylamino)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide is NC(=O)Nc1ccc(C(=O)Nc2ccc(N3CCCC3=O)cc2)cc1.
What is the InChIKey of 4-(carbamoylamino)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide?
The InChIKey is KNENLTPQIZWHAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O3/c19-18(25)21-14-5-3-12(4-6-14)17(24)20-13-7-9-15(10-8-13)22-11-1-2-16(22)23/h3-10H,1-2,11H2,(H,20,24)(H3,19,21,25).
What are the key properties of 4-(carbamoylamino)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide?
4-(carbamoylamino)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide has a molecular weight of 338.37 g/mol, XLogP of 2.56, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(carbamoylamino)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide is sourced from PubChem (CID 26127679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).