N-(2-imidazol-1-ylcyclopentyl)-3-methylpyrrolidine-3-carboxamide

C14H22N4O — CID 63140426

IUPACN-(2-imidazol-1-ylcyclopentyl)-3-methylpyrrolidine-3-carboxamide
SMILESCC1(C(=O)NC2CCCC2n2ccnc2)CCNC1
InChIInChI=1S/C14H22N4O/c1-14(5-6-15-9-14)13(19)17-11-3-2-4-12(11)18-8-7-16-10-18/h7-8,10-12,15H,2-6,9H2,1H3,(H,17,19)
InChIKeyVRTCOGKNWATBFP-UHFFFAOYSA-N
MW262.36 g/mol
LogP1.09
Rot. Bonds3

About N-(2-imidazol-1-ylcyclopentyl)-3-methylpyrrolidine-3-carboxamide

N-(2-imidazol-1-ylcyclopentyl)-3-methylpyrrolidine-3-carboxamide (PubChem CID 63140426) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is N-(2-imidazol-1-ylcyclopentyl)-3-methylpyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-(2-imidazol-1-ylcyclopentyl)-3-methylpyrrolidine-3-carboxamide
PubChem CID63140426
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC NameN-(2-imidazol-1-ylcyclopentyl)-3-methylpyrrolidine-3-carboxamide
SMILESCC1(C(=O)NC2CCCC2n2ccnc2)CCNC1
InChIInChI=1S/C14H22N4O/c1-14(5-6-15-9-14)13(19)17-11-3-2-4-12(11)18-8-7-16-10-18/h7-8,10-12,15H,2-6,9H2,1H3,(H,17,19)
InChIKeyVRTCOGKNWATBFP-UHFFFAOYSA-N
XLogP1.09
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(2-imidazol-1-ylcyclopentyl)-3-methylpyrrolidine-3-carboxamide 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 N-(2-imidazol-1-ylcyclopentyl)-3-methylpyrrolidine-3-carboxamide?
The IUPAC name of N-(2-imidazol-1-ylcyclopentyl)-3-methylpyrrolidine-3-carboxamide (CID 63140426) is N-(2-imidazol-1-ylcyclopentyl)-3-methylpyrrolidine-3-carboxamide.
What is the SMILES notation for N-(2-imidazol-1-ylcyclopentyl)-3-methylpyrrolidine-3-carboxamide?
The canonical SMILES for N-(2-imidazol-1-ylcyclopentyl)-3-methylpyrrolidine-3-carboxamide is CC1(C(=O)NC2CCCC2n2ccnc2)CCNC1.
What is the InChIKey of N-(2-imidazol-1-ylcyclopentyl)-3-methylpyrrolidine-3-carboxamide?
The InChIKey is VRTCOGKNWATBFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-14(5-6-15-9-14)13(19)17-11-3-2-4-12(11)18-8-7-16-10-18/h7-8,10-12,15H,2-6,9H2,1H3,(H,17,19).
What are the key properties of N-(2-imidazol-1-ylcyclopentyl)-3-methylpyrrolidine-3-carboxamide?
N-(2-imidazol-1-ylcyclopentyl)-3-methylpyrrolidine-3-carboxamide has a molecular weight of 262.36 g/mol, XLogP of 1.09, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-imidazol-1-ylcyclopentyl)-3-methylpyrrolidine-3-carboxamide is sourced from PubChem (CID 63140426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).