5-amino-5-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-3-methylpentanamide

C15H22N4O2 — CID 62941476

IUPAC5-amino-5-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-3-methylpentanamide
SMILESCC(CC(N)=O)CC(N)c1ccc2c(c1)n(C)c(=O)n2C
InChIInChI=1S/C15H22N4O2/c1-9(7-14(17)20)6-11(16)10-4-5-12-13(8-10)19(3)15(21)18(12)2/h4-5,8-9,11H,6-7,16H2,1-3H3,(H2,17,20)
InChIKeyGQXRSVWGMJPVAO-UHFFFAOYSA-N
MW290.37 g/mol
LogP0.78
Rot. Bonds5

About 5-amino-5-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-3-methylpentanamide

5-amino-5-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-3-methylpentanamide (PubChem CID 62941476) has the molecular formula C15H22N4O2 and a molecular weight of 290.37 g/mol. Its IUPAC name is 5-amino-5-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-3-methylpentanamide.

Molecular Properties

Compound Name5-amino-5-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-3-methylpentanamide
PubChem CID62941476
Molecular FormulaC15H22N4O2
Molecular Weight290.37 g/mol
Exact Mass290.17
IUPAC Name5-amino-5-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-3-methylpentanamide
SMILESCC(CC(N)=O)CC(N)c1ccc2c(c1)n(C)c(=O)n2C
InChIInChI=1S/C15H22N4O2/c1-9(7-14(17)20)6-11(16)10-4-5-12-13(8-10)19(3)15(21)18(12)2/h4-5,8-9,11H,6-7,16H2,1-3H3,(H2,17,20)
InChIKeyGQXRSVWGMJPVAO-UHFFFAOYSA-N
XLogP0.78
TPSA96.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 5-amino-5-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-3-methylpentanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-amino-5-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-3-methylpentanamide?
The IUPAC name of 5-amino-5-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-3-methylpentanamide (CID 62941476) is 5-amino-5-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-3-methylpentanamide.
What is the SMILES notation for 5-amino-5-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-3-methylpentanamide?
The canonical SMILES for 5-amino-5-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-3-methylpentanamide is CC(CC(N)=O)CC(N)c1ccc2c(c1)n(C)c(=O)n2C.
What is the InChIKey of 5-amino-5-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-3-methylpentanamide?
The InChIKey is GQXRSVWGMJPVAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O2/c1-9(7-14(17)20)6-11(16)10-4-5-12-13(8-10)19(3)15(21)18(12)2/h4-5,8-9,11H,6-7,16H2,1-3H3,(H2,17,20).
What are the key properties of 5-amino-5-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-3-methylpentanamide?
5-amino-5-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-3-methylpentanamide has a molecular weight of 290.37 g/mol, XLogP of 0.78, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-5-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-3-methylpentanamide is sourced from PubChem (CID 62941476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).