N-(2-imidazol-1-ylcyclopentyl)-4-(propan-2-ylamino)butanamide

C15H26N4O — CID 60851167

IUPACN-(2-imidazol-1-ylcyclopentyl)-4-(propan-2-ylamino)butanamide
SMILESCC(C)NCCCC(=O)NC1CCCC1n1ccnc1
InChIInChI=1S/C15H26N4O/c1-12(2)17-8-4-7-15(20)18-13-5-3-6-14(13)19-10-9-16-11-19/h9-14,17H,3-8H2,1-2H3,(H,18,20)
InChIKeyXARHLQOHQUWGAM-UHFFFAOYSA-N
MW278.40 g/mol
LogP1.87
Rot. Bonds7

About N-(2-imidazol-1-ylcyclopentyl)-4-(propan-2-ylamino)butanamide

N-(2-imidazol-1-ylcyclopentyl)-4-(propan-2-ylamino)butanamide (PubChem CID 60851167) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is N-(2-imidazol-1-ylcyclopentyl)-4-(propan-2-ylamino)butanamide.

Molecular Properties

Compound NameN-(2-imidazol-1-ylcyclopentyl)-4-(propan-2-ylamino)butanamide
PubChem CID60851167
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC NameN-(2-imidazol-1-ylcyclopentyl)-4-(propan-2-ylamino)butanamide
SMILESCC(C)NCCCC(=O)NC1CCCC1n1ccnc1
InChIInChI=1S/C15H26N4O/c1-12(2)17-8-4-7-15(20)18-13-5-3-6-14(13)19-10-9-16-11-19/h9-14,17H,3-8H2,1-2H3,(H,18,20)
InChIKeyXARHLQOHQUWGAM-UHFFFAOYSA-N
XLogP1.87
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-(2-imidazol-1-ylcyclopentyl)-4-(propan-2-ylamino)butanamide 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

5-chloro-N-(2-imidazol-1-ylcyclopentyl)pentanamide
CID 43701618
N-(2-imidazol-1-ylcyclopentyl)-2-(methylamino)acetamide
CID 43713522
2-amino-N-(2-imidazol-1-ylcyclopentyl)acetamide
CID 43713486
2-(aminomethyl)-N-(2-imidazol-1-ylcyclopentyl)-3-methylbutanamide
CID 65229653
2-imidazol-1-yl-N-(2-methylpropyl)cyclopentan-1-amine
CID 43734339
(3R)-4-(3-fluorophenyl)-N-[(1S,2R)-2-imidazol-1-ylcyclopentyl]-3-methyl-4-oxobutanamide
CID 124865976
2-[4-(aminomethyl)triazol-1-yl]-N-(2-imidazol-1-ylcyclopentyl)acetamide
CID 115459210
(2R)-2-amino-N-(2-imidazol-1-ylcyclopentyl)-4-methylsulfanylbutanamide
CID 104907460
N-butyl-2-imidazol-1-ylcyclopentan-1-amine
CID 43734458
cis-(1R,2S)-2-imidazol-1-yl-N-(3-methylbutyl)cyclohexan-1-amine
CID 165456995
2-amino-N-(2-imidazol-1-ylcyclopentyl)-2-methylpentanamide
CID 60847019
N-(2-imidazol-1-ylcyclopentyl)-3-methylpyrrolidine-3-carboxamide
CID 63140426

Frequently Asked Questions

What is the IUPAC name of N-(2-imidazol-1-ylcyclopentyl)-4-(propan-2-ylamino)butanamide?
The IUPAC name of N-(2-imidazol-1-ylcyclopentyl)-4-(propan-2-ylamino)butanamide (CID 60851167) is N-(2-imidazol-1-ylcyclopentyl)-4-(propan-2-ylamino)butanamide.
What is the SMILES notation for N-(2-imidazol-1-ylcyclopentyl)-4-(propan-2-ylamino)butanamide?
The canonical SMILES for N-(2-imidazol-1-ylcyclopentyl)-4-(propan-2-ylamino)butanamide is CC(C)NCCCC(=O)NC1CCCC1n1ccnc1.
What is the InChIKey of N-(2-imidazol-1-ylcyclopentyl)-4-(propan-2-ylamino)butanamide?
The InChIKey is XARHLQOHQUWGAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-12(2)17-8-4-7-15(20)18-13-5-3-6-14(13)19-10-9-16-11-19/h9-14,17H,3-8H2,1-2H3,(H,18,20).
What are the key properties of N-(2-imidazol-1-ylcyclopentyl)-4-(propan-2-ylamino)butanamide?
N-(2-imidazol-1-ylcyclopentyl)-4-(propan-2-ylamino)butanamide has a molecular weight of 278.40 g/mol, XLogP of 1.87, 7 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)-4-(propan-2-ylamino)butanamide is sourced from PubChem (CID 60851167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).