2-imidazol-1-yl-N-pentan-2-ylcyclopentan-1-amine

C13H23N3 — CID 43734394

IUPAC2-imidazol-1-yl-N-pentan-2-ylcyclopentan-1-amine
SMILESCCCC(C)NC1CCCC1n1ccnc1
InChIInChI=1S/C13H23N3/c1-3-5-11(2)15-12-6-4-7-13(12)16-9-8-14-10-16/h8-13,15H,3-7H2,1-2H3
InChIKeyGDOQDTAJLZSVQB-UHFFFAOYSA-N
MW221.35 g/mol
LogP2.75
Rot. Bonds5

About 2-imidazol-1-yl-N-pentan-2-ylcyclopentan-1-amine

2-imidazol-1-yl-N-pentan-2-ylcyclopentan-1-amine (PubChem CID 43734394) has the molecular formula C13H23N3 and a molecular weight of 221.35 g/mol. Its IUPAC name is 2-imidazol-1-yl-N-pentan-2-ylcyclopentan-1-amine.

Molecular Properties

Compound Name2-imidazol-1-yl-N-pentan-2-ylcyclopentan-1-amine
PubChem CID43734394
Molecular FormulaC13H23N3
Molecular Weight221.35 g/mol
Exact Mass221.19
IUPAC Name2-imidazol-1-yl-N-pentan-2-ylcyclopentan-1-amine
SMILESCCCC(C)NC1CCCC1n1ccnc1
InChIInChI=1S/C13H23N3/c1-3-5-11(2)15-12-6-4-7-13(12)16-9-8-14-10-16/h8-13,15H,3-7H2,1-2H3
InChIKeyGDOQDTAJLZSVQB-UHFFFAOYSA-N
XLogP2.75
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.35
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-imidazol-1-yl-N-pentan-2-ylcyclopentan-1-amine?
The IUPAC name of 2-imidazol-1-yl-N-pentan-2-ylcyclopentan-1-amine (CID 43734394) is 2-imidazol-1-yl-N-pentan-2-ylcyclopentan-1-amine.
What is the SMILES notation for 2-imidazol-1-yl-N-pentan-2-ylcyclopentan-1-amine?
The canonical SMILES for 2-imidazol-1-yl-N-pentan-2-ylcyclopentan-1-amine is CCCC(C)NC1CCCC1n1ccnc1.
What is the InChIKey of 2-imidazol-1-yl-N-pentan-2-ylcyclopentan-1-amine?
The InChIKey is GDOQDTAJLZSVQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3/c1-3-5-11(2)15-12-6-4-7-13(12)16-9-8-14-10-16/h8-13,15H,3-7H2,1-2H3.
What are the key properties of 2-imidazol-1-yl-N-pentan-2-ylcyclopentan-1-amine?
2-imidazol-1-yl-N-pentan-2-ylcyclopentan-1-amine has a molecular weight of 221.35 g/mol, XLogP of 2.75, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-imidazol-1-yl-N-pentan-2-ylcyclopentan-1-amine is sourced from PubChem (CID 43734394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).