N-methyl-4-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-N-pyrrolidin-3-ylbutanamide

C16H22N4O2 — CID 119553466

IUPACN-methyl-4-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-N-pyrrolidin-3-ylbutanamide
SMILESCN(C(=O)CCCc1ccc2[nH]c(=O)[nH]c2c1)C1CCNC1
InChIInChI=1S/C16H22N4O2/c1-20(12-7-8-17-10-12)15(21)4-2-3-11-5-6-13-14(9-11)19-16(22)18-13/h5-6,9,12,17H,2-4,7-8,10H2,1H3,(H2,18,19,22)
InChIKeyGCIAXMSKAUUFBP-UHFFFAOYSA-N
MW302.38 g/mol
LogP1.00
Rot. Bonds5

About N-methyl-4-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-N-pyrrolidin-3-ylbutanamide

N-methyl-4-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-N-pyrrolidin-3-ylbutanamide (PubChem CID 119553466) has the molecular formula C16H22N4O2 and a molecular weight of 302.38 g/mol. Its IUPAC name is N-methyl-4-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-N-pyrrolidin-3-ylbutanamide.

Molecular Properties

Compound NameN-methyl-4-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-N-pyrrolidin-3-ylbutanamide
PubChem CID119553466
Molecular FormulaC16H22N4O2
Molecular Weight302.38 g/mol
Exact Mass302.17
IUPAC NameN-methyl-4-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-N-pyrrolidin-3-ylbutanamide
SMILESCN(C(=O)CCCc1ccc2[nH]c(=O)[nH]c2c1)C1CCNC1
InChIInChI=1S/C16H22N4O2/c1-20(12-7-8-17-10-12)15(21)4-2-3-11-5-6-13-14(9-11)19-16(22)18-13/h5-6,9,12,17H,2-4,7-8,10H2,1H3,(H2,18,19,22)
InChIKeyGCIAXMSKAUUFBP-UHFFFAOYSA-N
XLogP1.00
TPSA80.99 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.38
LogP ≤ 51.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze N-methyl-4-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-N-pyrrolidin-3-ylbutanamide 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

4-(3,4-difluorophenyl)-N-methyl-N-pyrrolidin-3-ylbutanamide;hydrochloride
CID 119552359
N-methyl-4-(2-oxo-1,3-dihydroindol-5-yl)-N-pyrrolidin-3-ylbutanamide
CID 119552860
N-(2-hydroxy-2-methylpropyl)-N-methyl-4-(2-oxo-1,3-dihydrobenzimidazol-5-yl)butanamide
CID 111663080
N-methyl-4-(4-methylphenyl)-N-piperidin-4-ylbutanamide
CID 119443928
5-[4-[(2S)-2-methylpiperazin-1-yl]-4-oxobutyl]-1,3-dihydrobenzimidazol-2-one
CID 124571200
4-(4-butylphenyl)-N-methyl-4-oxo-N-pyrrolidin-3-ylbutanamide
CID 119554642
3-(4-methoxyphenyl)-N-methyl-N-pyrrolidin-3-ylpropanamide
CID 60806501
N',N'-diethyl-N-methyl-N-pyrrolidin-3-ylpentanediamide
CID 119550914
N-methyl-2-(4-methylphenyl)-N-pyrrolidin-3-ylacetamide
CID 55027680
N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]-4-(2-oxo-1,3-dihydrobenzimidazol-5-yl)butanamide
CID 56782403
4-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-N-(pyrrolidin-2-ylmethyl)butanamide;hydrochloride
CID 119513434
N,4,4-trimethyl-N-pyrrolidin-3-ylpentanamide;hydrochloride
CID 119554778

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-N-pyrrolidin-3-ylbutanamide?
The IUPAC name of N-methyl-4-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-N-pyrrolidin-3-ylbutanamide (CID 119553466) is N-methyl-4-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-N-pyrrolidin-3-ylbutanamide.
What is the SMILES notation for N-methyl-4-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-N-pyrrolidin-3-ylbutanamide?
The canonical SMILES for N-methyl-4-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-N-pyrrolidin-3-ylbutanamide is CN(C(=O)CCCc1ccc2[nH]c(=O)[nH]c2c1)C1CCNC1.
What is the InChIKey of N-methyl-4-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-N-pyrrolidin-3-ylbutanamide?
The InChIKey is GCIAXMSKAUUFBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4O2/c1-20(12-7-8-17-10-12)15(21)4-2-3-11-5-6-13-14(9-11)19-16(22)18-13/h5-6,9,12,17H,2-4,7-8,10H2,1H3,(H2,18,19,22).
What are the key properties of N-methyl-4-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-N-pyrrolidin-3-ylbutanamide?
N-methyl-4-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-N-pyrrolidin-3-ylbutanamide has a molecular weight of 302.38 g/mol, XLogP of 1.00, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-N-pyrrolidin-3-ylbutanamide is sourced from PubChem (CID 119553466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).