1-[(2-methylcyclopentyl)methyl]-5-pyrrolidin-2-ylimidazole

C14H23N3 — CID 107421507

IUPAC1-[(2-methylcyclopentyl)methyl]-5-pyrrolidin-2-ylimidazole
SMILESCC1CCCC1Cn1cncc1C1CCCN1
InChIInChI=1S/C14H23N3/c1-11-4-2-5-12(11)9-17-10-15-8-14(17)13-6-3-7-16-13/h8,10-13,16H,2-7,9H2,1H3
InChIKeyDGMHNSSWLXPMGX-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.74
Rot. Bonds3

About 1-[(2-methylcyclopentyl)methyl]-5-pyrrolidin-2-ylimidazole

1-[(2-methylcyclopentyl)methyl]-5-pyrrolidin-2-ylimidazole (PubChem CID 107421507) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is 1-[(2-methylcyclopentyl)methyl]-5-pyrrolidin-2-ylimidazole.

Molecular Properties

Compound Name1-[(2-methylcyclopentyl)methyl]-5-pyrrolidin-2-ylimidazole
PubChem CID107421507
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC Name1-[(2-methylcyclopentyl)methyl]-5-pyrrolidin-2-ylimidazole
SMILESCC1CCCC1Cn1cncc1C1CCCN1
InChIInChI=1S/C14H23N3/c1-11-4-2-5-12(11)9-17-10-15-8-14(17)13-6-3-7-16-13/h8,10-13,16H,2-7,9H2,1H3
InChIKeyDGMHNSSWLXPMGX-UHFFFAOYSA-N
XLogP2.74
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[(2-methylcyclopentyl)methyl]-5-pyrrolidin-2-ylimidazole 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 1-[(2-methylcyclopentyl)methyl]-5-pyrrolidin-2-ylimidazole?
The IUPAC name of 1-[(2-methylcyclopentyl)methyl]-5-pyrrolidin-2-ylimidazole (CID 107421507) is 1-[(2-methylcyclopentyl)methyl]-5-pyrrolidin-2-ylimidazole.
What is the SMILES notation for 1-[(2-methylcyclopentyl)methyl]-5-pyrrolidin-2-ylimidazole?
The canonical SMILES for 1-[(2-methylcyclopentyl)methyl]-5-pyrrolidin-2-ylimidazole is CC1CCCC1Cn1cncc1C1CCCN1.
What is the InChIKey of 1-[(2-methylcyclopentyl)methyl]-5-pyrrolidin-2-ylimidazole?
The InChIKey is DGMHNSSWLXPMGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-11-4-2-5-12(11)9-17-10-15-8-14(17)13-6-3-7-16-13/h8,10-13,16H,2-7,9H2,1H3.
What are the key properties of 1-[(2-methylcyclopentyl)methyl]-5-pyrrolidin-2-ylimidazole?
1-[(2-methylcyclopentyl)methyl]-5-pyrrolidin-2-ylimidazole has a molecular weight of 233.36 g/mol, XLogP of 2.74, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-methylcyclopentyl)methyl]-5-pyrrolidin-2-ylimidazole is sourced from PubChem (CID 107421507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).