N-(3-aminobutyl)-4-(2-oxoimidazolidin-1-yl)benzamide

C14H20N4O2 — CID 119497450

IUPACN-(3-aminobutyl)-4-(2-oxoimidazolidin-1-yl)benzamide
SMILESCC(N)CCNC(=O)c1ccc(N2CCNC2=O)cc1
InChIInChI=1S/C14H20N4O2/c1-10(15)6-7-16-13(19)11-2-4-12(5-3-11)18-9-8-17-14(18)20/h2-5,10H,6-9,15H2,1H3,(H,16,19)(H,17,20)
InChIKeyIFZWBPRYWHXHML-UHFFFAOYSA-N
MW276.34 g/mol
LogP0.68
Rot. Bonds5

About N-(3-aminobutyl)-4-(2-oxoimidazolidin-1-yl)benzamide

N-(3-aminobutyl)-4-(2-oxoimidazolidin-1-yl)benzamide (PubChem CID 119497450) has the molecular formula C14H20N4O2 and a molecular weight of 276.34 g/mol. Its IUPAC name is N-(3-aminobutyl)-4-(2-oxoimidazolidin-1-yl)benzamide.

Molecular Properties

Compound NameN-(3-aminobutyl)-4-(2-oxoimidazolidin-1-yl)benzamide
PubChem CID119497450
Molecular FormulaC14H20N4O2
Molecular Weight276.34 g/mol
Exact Mass276.16
IUPAC NameN-(3-aminobutyl)-4-(2-oxoimidazolidin-1-yl)benzamide
SMILESCC(N)CCNC(=O)c1ccc(N2CCNC2=O)cc1
InChIInChI=1S/C14H20N4O2/c1-10(15)6-7-16-13(19)11-2-4-12(5-3-11)18-9-8-17-14(18)20/h2-5,10H,6-9,15H2,1H3,(H,16,19)(H,17,20)
InChIKeyIFZWBPRYWHXHML-UHFFFAOYSA-N
XLogP0.68
TPSA87.46 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 50.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(2-fluorophenyl)ethyl]-4-(2-oxoimidazolidin-1-yl)benzamide
CID 51299311
7-[[4-(2-oxoimidazolidin-1-yl)benzoyl]amino]heptanoic acid
CID 119227169
N-[[2-(hydroxymethyl)phenyl]methyl]-4-(2-oxoimidazolidin-1-yl)benzamide
CID 71883331
N-(1-amino-2,3-dimethylbutan-2-yl)-4-(2-oxoimidazolidin-1-yl)benzamide;hydrochloride
CID 119607404
4-(2-oxoimidazolidin-1-yl)-N-(2-thiophen-2-ylethyl)benzamide
CID 51074825
(2S)-3-methyl-2-[[4-(2-oxoimidazolidin-1-yl)benzoyl]amino]butanoic acid
CID 119360751
(2S)-4-methyl-2-[[4-(2-oxoimidazolidin-1-yl)benzoyl]amino]pentanoic acid
CID 119362177
N-[(2-methoxyphenyl)methyl]-4-(2-oxoimidazolidin-1-yl)benzamide
CID 51299036
N-(3-aminobutyl)-4-methylbenzamide;hydrochloride
CID 119497304
N-(2-methylphenyl)-4-(2-oxoimidazolidin-1-yl)benzamide
CID 46687823
N-(3-aminobutyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
CID 103806261
2-amino-N-[4-(2-oxoimidazolidin-1-yl)phenyl]propanamide;hydrochloride
CID 119276066

Frequently Asked Questions

What is the IUPAC name of N-(3-aminobutyl)-4-(2-oxoimidazolidin-1-yl)benzamide?
The IUPAC name of N-(3-aminobutyl)-4-(2-oxoimidazolidin-1-yl)benzamide (CID 119497450) is N-(3-aminobutyl)-4-(2-oxoimidazolidin-1-yl)benzamide.
What is the SMILES notation for N-(3-aminobutyl)-4-(2-oxoimidazolidin-1-yl)benzamide?
The canonical SMILES for N-(3-aminobutyl)-4-(2-oxoimidazolidin-1-yl)benzamide is CC(N)CCNC(=O)c1ccc(N2CCNC2=O)cc1.
What is the InChIKey of N-(3-aminobutyl)-4-(2-oxoimidazolidin-1-yl)benzamide?
The InChIKey is IFZWBPRYWHXHML-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O2/c1-10(15)6-7-16-13(19)11-2-4-12(5-3-11)18-9-8-17-14(18)20/h2-5,10H,6-9,15H2,1H3,(H,16,19)(H,17,20).
What are the key properties of N-(3-aminobutyl)-4-(2-oxoimidazolidin-1-yl)benzamide?
N-(3-aminobutyl)-4-(2-oxoimidazolidin-1-yl)benzamide has a molecular weight of 276.34 g/mol, XLogP of 0.68, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminobutyl)-4-(2-oxoimidazolidin-1-yl)benzamide is sourced from PubChem (CID 119497450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).