N-(2-imidazol-1-ylcyclopentyl)cyclohexanecarboxamide

C15H23N3O — CID 56812384

IUPACN-(2-imidazol-1-ylcyclopentyl)cyclohexanecarboxamide
SMILESO=C(NC1CCCC1n1ccnc1)C1CCCCC1
InChIInChI=1S/C15H23N3O/c19-15(12-5-2-1-3-6-12)17-13-7-4-8-14(13)18-10-9-16-11-18/h9-14H,1-8H2,(H,17,19)
InChIKeyYZDOLTNTFDRBKZ-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.67
Rot. Bonds3

About N-(2-imidazol-1-ylcyclopentyl)cyclohexanecarboxamide

N-(2-imidazol-1-ylcyclopentyl)cyclohexanecarboxamide (PubChem CID 56812384) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is N-(2-imidazol-1-ylcyclopentyl)cyclohexanecarboxamide.

Molecular Properties

Compound NameN-(2-imidazol-1-ylcyclopentyl)cyclohexanecarboxamide
PubChem CID56812384
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC NameN-(2-imidazol-1-ylcyclopentyl)cyclohexanecarboxamide
SMILESO=C(NC1CCCC1n1ccnc1)C1CCCCC1
InChIInChI=1S/C15H23N3O/c19-15(12-5-2-1-3-6-12)17-13-7-4-8-14(13)18-10-9-16-11-18/h9-14H,1-8H2,(H,17,19)
InChIKeyYZDOLTNTFDRBKZ-UHFFFAOYSA-N
XLogP2.67
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-imidazol-1-ylcyclopentyl)cyclohexanecarboxamide?
The IUPAC name of N-(2-imidazol-1-ylcyclopentyl)cyclohexanecarboxamide (CID 56812384) is N-(2-imidazol-1-ylcyclopentyl)cyclohexanecarboxamide.
What is the SMILES notation for N-(2-imidazol-1-ylcyclopentyl)cyclohexanecarboxamide?
The canonical SMILES for N-(2-imidazol-1-ylcyclopentyl)cyclohexanecarboxamide is O=C(NC1CCCC1n1ccnc1)C1CCCCC1.
What is the InChIKey of N-(2-imidazol-1-ylcyclopentyl)cyclohexanecarboxamide?
The InChIKey is YZDOLTNTFDRBKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c19-15(12-5-2-1-3-6-12)17-13-7-4-8-14(13)18-10-9-16-11-18/h9-14H,1-8H2,(H,17,19).
What are the key properties of N-(2-imidazol-1-ylcyclopentyl)cyclohexanecarboxamide?
N-(2-imidazol-1-ylcyclopentyl)cyclohexanecarboxamide has a molecular weight of 261.37 g/mol, XLogP of 2.67, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-imidazol-1-ylcyclopentyl)cyclohexanecarboxamide is sourced from PubChem (CID 56812384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).