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

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Related Compounds

(1R,2R)-N-(2-(4-(2-Oxo-2,3-dihydro-1H-benzo[d]imidazol-1-yl)piperidin-1-yl)ethyl)-2-phenylcyclopropanecarboxamide
CID 25105706
N-(3-ethylphenyl)-6-(5-methyl-2-oxoimidazolidin-4-yl)hexanamide
CID 4916632
5-(aminomethyl)-1,3-dimethyl-2,3-dihydro-1H-1,3-benzodiazol-2-one
CID 757168
compound 1 (PMID: 25408830)
CID 1091852
Pyrrolidine-1,2-dicarboxylic acid 2-[(2-cyclohex-1-enyl-ethyl)-amide] 1-p-tolylamide
CID 644827
6-(5-methyl-2-oxoimidazolidin-4-yl)-N-(4-methylphenyl)hexanamide
CID 2972189
2-oxo-N-phenyl-1-propan-2-yl-3H-benzimidazole-5-carboxamide
CID 3232144
6-benzoyl-3-(cyclohexylmethyl)-1H-benzimidazol-2-one
CID 44420193
trans-(1R,2R)-N-[2-[2-methyl-4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]ethyl]-2-phenylcyclopropane-1-carboxamide
CID 118722108
(E)-N-hydroxy-3-[1-methyl-2-[2-[(2-phenylacetyl)amino]ethyl]-2,3-dihydrobenzimidazol-5-yl]prop-2-enamide
CID 89839476
5-(Indoline-1-carbonyl)-1H-benzo[d]imidazol-2(3H)-one
CID 169489605
5-Acetyl-1,3-Dimethyl-1H-Benzo[D]Imidazol-2(3H)-One
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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).