N-(1H-benzimidazol-2-yl)-2-propylpyrrolidine-2-carboxamide

C15H20N4O — CID 106975213

IUPACN-(1H-benzimidazol-2-yl)-2-propylpyrrolidine-2-carboxamide
SMILESCCCC1(C(=O)Nc2nc3ccccc3[nH]2)CCCN1
InChIInChI=1S/C15H20N4O/c1-2-8-15(9-5-10-16-15)13(20)19-14-17-11-6-3-4-7-12(11)18-14/h3-4,6-7,16H,2,5,8-10H2,1H3,(H2,17,18,19,20)
InChIKeyQXNHOJBIPVHVDS-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.42
Rot. Bonds4

About N-(1H-benzimidazol-2-yl)-2-propylpyrrolidine-2-carboxamide

N-(1H-benzimidazol-2-yl)-2-propylpyrrolidine-2-carboxamide (PubChem CID 106975213) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is N-(1H-benzimidazol-2-yl)-2-propylpyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-(1H-benzimidazol-2-yl)-2-propylpyrrolidine-2-carboxamide
PubChem CID106975213
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC NameN-(1H-benzimidazol-2-yl)-2-propylpyrrolidine-2-carboxamide
SMILESCCCC1(C(=O)Nc2nc3ccccc3[nH]2)CCCN1
InChIInChI=1S/C15H20N4O/c1-2-8-15(9-5-10-16-15)13(20)19-14-17-11-6-3-4-7-12(11)18-14/h3-4,6-7,16H,2,5,8-10H2,1H3,(H2,17,18,19,20)
InChIKeyQXNHOJBIPVHVDS-UHFFFAOYSA-N
XLogP2.42
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.42
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-propylpyrrolidin-2-yl)-1H-benzimidazole
CID 106977720
N-(4-ethylphenyl)-2-propylpyrrolidine-2-carboxamide
CID 106974084
N-(1H-benzimidazol-2-yl)-3-methylpyrrolidine-3-carboxamide
CID 63562778
N-(1H-benzimidazol-2-yl)-1-carbamothioylcyclopentane-1-carboxamide
CID 63563740
N-(2-ethylsulfanylphenyl)-2-propylpyrrolidine-2-carboxamide
CID 106974526
2-propyl-N-quinolin-8-ylpyrrolidine-2-carboxamide
CID 106973994
N-(2-nitrophenyl)-2-propylpyrrolidine-2-carboxamide
CID 106974417
N-(4-carbamoylphenyl)-2-propylpyrrolidine-2-carboxamide
CID 106974031
N-(1H-benzimidazol-2-yl)-3-propan-2-ylpyrrolidine-3-carboxamide
CID 106980681
N-(1H-benzimidazol-2-yl)-2,2-dichloro-1-methylcyclopropane-1-carboxamide
CID 43016841
methyl 4-[(2-propylpyrrolidine-2-carbonyl)amino]benzoate
CID 106974927
1-(aminomethyl)-N-(1H-benzimidazol-2-yl)-4-methylcyclohexane-1-carboxamide
CID 115442160

Frequently Asked Questions

What is the IUPAC name of N-(1H-benzimidazol-2-yl)-2-propylpyrrolidine-2-carboxamide?
The IUPAC name of N-(1H-benzimidazol-2-yl)-2-propylpyrrolidine-2-carboxamide (CID 106975213) is N-(1H-benzimidazol-2-yl)-2-propylpyrrolidine-2-carboxamide.
What is the SMILES notation for N-(1H-benzimidazol-2-yl)-2-propylpyrrolidine-2-carboxamide?
The canonical SMILES for N-(1H-benzimidazol-2-yl)-2-propylpyrrolidine-2-carboxamide is CCCC1(C(=O)Nc2nc3ccccc3[nH]2)CCCN1.
What is the InChIKey of N-(1H-benzimidazol-2-yl)-2-propylpyrrolidine-2-carboxamide?
The InChIKey is QXNHOJBIPVHVDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-2-8-15(9-5-10-16-15)13(20)19-14-17-11-6-3-4-7-12(11)18-14/h3-4,6-7,16H,2,5,8-10H2,1H3,(H2,17,18,19,20).
What are the key properties of N-(1H-benzimidazol-2-yl)-2-propylpyrrolidine-2-carboxamide?
N-(1H-benzimidazol-2-yl)-2-propylpyrrolidine-2-carboxamide has a molecular weight of 272.35 g/mol, XLogP of 2.42, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-benzimidazol-2-yl)-2-propylpyrrolidine-2-carboxamide is sourced from PubChem (CID 106975213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).