N-(3-amino-4-methylpentyl)-1-cyclopentyl-N-methyl-2-oxo-3H-benzimidazole-5-carboxamide

C20H30N4O2 — CID 119660783

IUPACN-(3-amino-4-methylpentyl)-1-cyclopentyl-N-methyl-2-oxo-3H-benzimidazole-5-carboxamide
SMILESCC(C)C(N)CCN(C)C(=O)c1ccc2c(c1)[nH]c(=O)n2C1CCCC1
InChIInChI=1S/C20H30N4O2/c1-13(2)16(21)10-11-23(3)19(25)14-8-9-18-17(12-14)22-20(26)24(18)15-6-4-5-7-15/h8-9,12-13,15-16H,4-7,10-11,21H2,1-3H3,(H,22,26)
InChIKeyCIWGDJNQRLJPRA-UHFFFAOYSA-N
MW358.49 g/mol
LogP2.89
Rot. Bonds6

About N-(3-amino-4-methylpentyl)-1-cyclopentyl-N-methyl-2-oxo-3H-benzimidazole-5-carboxamide

N-(3-amino-4-methylpentyl)-1-cyclopentyl-N-methyl-2-oxo-3H-benzimidazole-5-carboxamide (PubChem CID 119660783) has the molecular formula C20H30N4O2 and a molecular weight of 358.49 g/mol. Its IUPAC name is N-(3-amino-4-methylpentyl)-1-cyclopentyl-N-methyl-2-oxo-3H-benzimidazole-5-carboxamide.

Molecular Properties

Compound NameN-(3-amino-4-methylpentyl)-1-cyclopentyl-N-methyl-2-oxo-3H-benzimidazole-5-carboxamide
PubChem CID119660783
Molecular FormulaC20H30N4O2
Molecular Weight358.49 g/mol
Exact Mass358.24
IUPAC NameN-(3-amino-4-methylpentyl)-1-cyclopentyl-N-methyl-2-oxo-3H-benzimidazole-5-carboxamide
SMILESCC(C)C(N)CCN(C)C(=O)c1ccc2c(c1)[nH]c(=O)n2C1CCCC1
InChIInChI=1S/C20H30N4O2/c1-13(2)16(21)10-11-23(3)19(25)14-8-9-18-17(12-14)22-20(26)24(18)15-6-4-5-7-15/h8-9,12-13,15-16H,4-7,10-11,21H2,1-3H3,(H,22,26)
InChIKeyCIWGDJNQRLJPRA-UHFFFAOYSA-N
XLogP2.89
TPSA84.12 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.49
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(3-amino-4-methylpentyl)-1-cyclopentyl-N-methyl-2-oxo-3H-benzimidazole-5-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

1-cyclopentyl-N-(cyclopropylmethyl)-N-methyl-2-oxo-3H-benzimidazole-5-carboxamide
CID 71880640
N-(2-aminoethyl)-1-cyclopentyl-2-oxo-N-(2-phenylethyl)-3H-benzimidazole-5-carboxamide;hydrochloride
CID 120884273
6-[4-(1-aminoethyl)piperidine-1-carbonyl]-3-cyclopentyl-1H-benzimidazol-2-one;hydrochloride
CID 119520393
(2R)-2-[(1-cyclopentyl-2-oxo-3H-benzimidazole-5-carbonyl)amino]-3-methylbutanoic acid
CID 119368330
1-cyclopentyl-2-oxo-N-propyl-N-pyrrolidin-3-yl-3H-benzimidazole-5-carboxamide;hydrochloride
CID 119532706
1-(4-hydroxycyclohexyl)-N-methyl-N-[(5-methyl-1H-imidazol-2-yl)methyl]-2-oxo-3H-benzimidazole-5-carboxamide
CID 70771618
N-(3-amino-4-methylpentyl)-N-methyl-2-oxo-1,3-dihydroindole-5-carboxamide
CID 102711691
(3-methyloxetan-3-yl)methyl 1-cyclopentyl-2-oxo-3H-benzimidazole-5-carboxylate
CID 95905270
1-cyclopentyl-N-cyclopropyl-N-(2,5-dioxopyrrolidin-3-yl)-2-oxo-3H-benzimidazole-5-carboxamide
CID 136522609
1-(4-hydroxycyclohexyl)-N-methyl-N-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]-2-oxo-3H-benzimidazole-5-carboxamide
CID 70710905
6-[3-(aminomethyl)pyrrolidine-1-carbonyl]-3-cyclopentyl-1H-benzimidazol-2-one
CID 119486752
3-cyclopropyl-6-[2-(methylamino)acetyl]-1H-benzimidazol-2-one
CID 117365069

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-4-methylpentyl)-1-cyclopentyl-N-methyl-2-oxo-3H-benzimidazole-5-carboxamide?
The IUPAC name of N-(3-amino-4-methylpentyl)-1-cyclopentyl-N-methyl-2-oxo-3H-benzimidazole-5-carboxamide (CID 119660783) is N-(3-amino-4-methylpentyl)-1-cyclopentyl-N-methyl-2-oxo-3H-benzimidazole-5-carboxamide.
What is the SMILES notation for N-(3-amino-4-methylpentyl)-1-cyclopentyl-N-methyl-2-oxo-3H-benzimidazole-5-carboxamide?
The canonical SMILES for N-(3-amino-4-methylpentyl)-1-cyclopentyl-N-methyl-2-oxo-3H-benzimidazole-5-carboxamide is CC(C)C(N)CCN(C)C(=O)c1ccc2c(c1)[nH]c(=O)n2C1CCCC1.
What is the InChIKey of N-(3-amino-4-methylpentyl)-1-cyclopentyl-N-methyl-2-oxo-3H-benzimidazole-5-carboxamide?
The InChIKey is CIWGDJNQRLJPRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N4O2/c1-13(2)16(21)10-11-23(3)19(25)14-8-9-18-17(12-14)22-20(26)24(18)15-6-4-5-7-15/h8-9,12-13,15-16H,4-7,10-11,21H2,1-3H3,(H,22,26).
What are the key properties of N-(3-amino-4-methylpentyl)-1-cyclopentyl-N-methyl-2-oxo-3H-benzimidazole-5-carboxamide?
N-(3-amino-4-methylpentyl)-1-cyclopentyl-N-methyl-2-oxo-3H-benzimidazole-5-carboxamide has a molecular weight of 358.49 g/mol, XLogP of 2.89, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-4-methylpentyl)-1-cyclopentyl-N-methyl-2-oxo-3H-benzimidazole-5-carboxamide is sourced from PubChem (CID 119660783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).