3-cyclopentyl-3-(2-methylpentyl)azetidine

C14H27N — CID 112571330

IUPAC3-cyclopentyl-3-(2-methylpentyl)azetidine
SMILESCCCC(C)CC1(C2CCCC2)CNC1
InChIInChI=1S/C14H27N/c1-3-6-12(2)9-14(10-15-11-14)13-7-4-5-8-13/h12-13,15H,3-11H2,1-2H3
InChIKeyRVQGNQVXIGNDFB-UHFFFAOYSA-N
MW209.38 g/mol
LogP3.59
Rot. Bonds5

About 3-cyclopentyl-3-(2-methylpentyl)azetidine

3-cyclopentyl-3-(2-methylpentyl)azetidine (PubChem CID 112571330) has the molecular formula C14H27N and a molecular weight of 209.38 g/mol. Its IUPAC name is 3-cyclopentyl-3-(2-methylpentyl)azetidine.

Molecular Properties

Compound Name3-cyclopentyl-3-(2-methylpentyl)azetidine
PubChem CID112571330
Molecular FormulaC14H27N
Molecular Weight209.38 g/mol
Exact Mass209.21
IUPAC Name3-cyclopentyl-3-(2-methylpentyl)azetidine
SMILESCCCC(C)CC1(C2CCCC2)CNC1
InChIInChI=1S/C14H27N/c1-3-6-12(2)9-14(10-15-11-14)13-7-4-5-8-13/h12-13,15H,3-11H2,1-2H3
InChIKeyRVQGNQVXIGNDFB-UHFFFAOYSA-N
XLogP3.59
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.38
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-3-(2-methylpentyl)azetidine?
The IUPAC name of 3-cyclopentyl-3-(2-methylpentyl)azetidine (CID 112571330) is 3-cyclopentyl-3-(2-methylpentyl)azetidine.
What is the SMILES notation for 3-cyclopentyl-3-(2-methylpentyl)azetidine?
The canonical SMILES for 3-cyclopentyl-3-(2-methylpentyl)azetidine is CCCC(C)CC1(C2CCCC2)CNC1.
What is the InChIKey of 3-cyclopentyl-3-(2-methylpentyl)azetidine?
The InChIKey is RVQGNQVXIGNDFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N/c1-3-6-12(2)9-14(10-15-11-14)13-7-4-5-8-13/h12-13,15H,3-11H2,1-2H3.
What are the key properties of 3-cyclopentyl-3-(2-methylpentyl)azetidine?
3-cyclopentyl-3-(2-methylpentyl)azetidine has a molecular weight of 209.38 g/mol, XLogP of 3.59, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-3-(2-methylpentyl)azetidine is sourced from PubChem (CID 112571330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).