N-(1-amino-2,4-dimethylpentan-2-yl)-4-chloro-3-(2-oxoimidazolidin-1-yl)benzamide

C17H25ClN4O2 — CID 119599252

IUPACN-(1-amino-2,4-dimethylpentan-2-yl)-4-chloro-3-(2-oxoimidazolidin-1-yl)benzamide
SMILESCC(C)CC(C)(CN)NC(=O)c1ccc(Cl)c(N2CCNC2=O)c1
InChIInChI=1S/C17H25ClN4O2/c1-11(2)9-17(3,10-19)21-15(23)12-4-5-13(18)14(8-12)22-7-6-20-16(22)24/h4-5,8,11H,6-7,9-10,19H2,1-3H3,(H,20,24)(H,21,23)
InChIKeyWZDKAPGXJNZMQY-UHFFFAOYSA-N
MW352.87 g/mol
LogP2.36
Rot. Bonds6

About N-(1-amino-2,4-dimethylpentan-2-yl)-4-chloro-3-(2-oxoimidazolidin-1-yl)benzamide

N-(1-amino-2,4-dimethylpentan-2-yl)-4-chloro-3-(2-oxoimidazolidin-1-yl)benzamide (PubChem CID 119599252) has the molecular formula C17H25ClN4O2 and a molecular weight of 352.87 g/mol. Its IUPAC name is N-(1-amino-2,4-dimethylpentan-2-yl)-4-chloro-3-(2-oxoimidazolidin-1-yl)benzamide.

Molecular Properties

Compound NameN-(1-amino-2,4-dimethylpentan-2-yl)-4-chloro-3-(2-oxoimidazolidin-1-yl)benzamide
PubChem CID119599252
Molecular FormulaC17H25ClN4O2
Molecular Weight352.87 g/mol
Exact Mass352.17
IUPAC NameN-(1-amino-2,4-dimethylpentan-2-yl)-4-chloro-3-(2-oxoimidazolidin-1-yl)benzamide
SMILESCC(C)CC(C)(CN)NC(=O)c1ccc(Cl)c(N2CCNC2=O)c1
InChIInChI=1S/C17H25ClN4O2/c1-11(2)9-17(3,10-19)21-15(23)12-4-5-13(18)14(8-12)22-7-6-20-16(22)24/h4-5,8,11H,6-7,9-10,19H2,1-3H3,(H,20,24)(H,21,23)
InChIKeyWZDKAPGXJNZMQY-UHFFFAOYSA-N
XLogP2.36
TPSA87.46 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.87
LogP ≤ 52.36
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2,4-dimethylpentan-2-yl)-4-chloro-3-(2-oxoimidazolidin-1-yl)benzamide?
The IUPAC name of N-(1-amino-2,4-dimethylpentan-2-yl)-4-chloro-3-(2-oxoimidazolidin-1-yl)benzamide (CID 119599252) is N-(1-amino-2,4-dimethylpentan-2-yl)-4-chloro-3-(2-oxoimidazolidin-1-yl)benzamide.
What is the SMILES notation for N-(1-amino-2,4-dimethylpentan-2-yl)-4-chloro-3-(2-oxoimidazolidin-1-yl)benzamide?
The canonical SMILES for N-(1-amino-2,4-dimethylpentan-2-yl)-4-chloro-3-(2-oxoimidazolidin-1-yl)benzamide is CC(C)CC(C)(CN)NC(=O)c1ccc(Cl)c(N2CCNC2=O)c1.
What is the InChIKey of N-(1-amino-2,4-dimethylpentan-2-yl)-4-chloro-3-(2-oxoimidazolidin-1-yl)benzamide?
The InChIKey is WZDKAPGXJNZMQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25ClN4O2/c1-11(2)9-17(3,10-19)21-15(23)12-4-5-13(18)14(8-12)22-7-6-20-16(22)24/h4-5,8,11H,6-7,9-10,19H2,1-3H3,(H,20,24)(H,21,23).
What are the key properties of N-(1-amino-2,4-dimethylpentan-2-yl)-4-chloro-3-(2-oxoimidazolidin-1-yl)benzamide?
N-(1-amino-2,4-dimethylpentan-2-yl)-4-chloro-3-(2-oxoimidazolidin-1-yl)benzamide has a molecular weight of 352.87 g/mol, XLogP of 2.36, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2,4-dimethylpentan-2-yl)-4-chloro-3-(2-oxoimidazolidin-1-yl)benzamide is sourced from PubChem (CID 119599252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).