[1-[2-(2-cyclopentylpyrrolidin-1-yl)ethyl]cyclobutyl]methanamine

C16H30N2 — CID 81170586

IUPAC[1-[2-(2-cyclopentylpyrrolidin-1-yl)ethyl]cyclobutyl]methanamine
SMILESNCC1(CCN2CCCC2C2CCCC2)CCC1
InChIInChI=1S/C16H30N2/c17-13-16(8-4-9-16)10-12-18-11-3-7-15(18)14-5-1-2-6-14/h14-15H,1-13,17H2
InChIKeyOAVCELXRIIYQNN-UHFFFAOYSA-N
MW250.43 g/mol
LogP3.16
Rot. Bonds5

About [1-[2-(2-cyclopentylpyrrolidin-1-yl)ethyl]cyclobutyl]methanamine

[1-[2-(2-cyclopentylpyrrolidin-1-yl)ethyl]cyclobutyl]methanamine (PubChem CID 81170586) has the molecular formula C16H30N2 and a molecular weight of 250.43 g/mol. Its IUPAC name is [1-[2-(2-cyclopentylpyrrolidin-1-yl)ethyl]cyclobutyl]methanamine.

Molecular Properties

Compound Name[1-[2-(2-cyclopentylpyrrolidin-1-yl)ethyl]cyclobutyl]methanamine
PubChem CID81170586
Molecular FormulaC16H30N2
Molecular Weight250.43 g/mol
Exact Mass250.24
IUPAC Name[1-[2-(2-cyclopentylpyrrolidin-1-yl)ethyl]cyclobutyl]methanamine
SMILESNCC1(CCN2CCCC2C2CCCC2)CCC1
InChIInChI=1S/C16H30N2/c17-13-16(8-4-9-16)10-12-18-11-3-7-15(18)14-5-1-2-6-14/h14-15H,1-13,17H2
InChIKeyOAVCELXRIIYQNN-UHFFFAOYSA-N
XLogP3.16
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.43
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [1-[2-(2-cyclopentylpyrrolidin-1-yl)ethyl]cyclobutyl]methanamine?
The IUPAC name of [1-[2-(2-cyclopentylpyrrolidin-1-yl)ethyl]cyclobutyl]methanamine (CID 81170586) is [1-[2-(2-cyclopentylpyrrolidin-1-yl)ethyl]cyclobutyl]methanamine.
What is the SMILES notation for [1-[2-(2-cyclopentylpyrrolidin-1-yl)ethyl]cyclobutyl]methanamine?
The canonical SMILES for [1-[2-(2-cyclopentylpyrrolidin-1-yl)ethyl]cyclobutyl]methanamine is NCC1(CCN2CCCC2C2CCCC2)CCC1.
What is the InChIKey of [1-[2-(2-cyclopentylpyrrolidin-1-yl)ethyl]cyclobutyl]methanamine?
The InChIKey is OAVCELXRIIYQNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2/c17-13-16(8-4-9-16)10-12-18-11-3-7-15(18)14-5-1-2-6-14/h14-15H,1-13,17H2.
What are the key properties of [1-[2-(2-cyclopentylpyrrolidin-1-yl)ethyl]cyclobutyl]methanamine?
[1-[2-(2-cyclopentylpyrrolidin-1-yl)ethyl]cyclobutyl]methanamine has a molecular weight of 250.43 g/mol, XLogP of 3.16, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[2-(2-cyclopentylpyrrolidin-1-yl)ethyl]cyclobutyl]methanamine is sourced from PubChem (CID 81170586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).