2-cyclobutyl-N-methyl-N-(2-pyrrolidin-3-ylethyl)ethanamine

C13H26N2 — CID 115210939

IUPAC2-cyclobutyl-N-methyl-N-(2-pyrrolidin-3-ylethyl)ethanamine
SMILESCN(CCC1CCC1)CCC1CCNC1
InChIInChI=1S/C13H26N2/c1-15(9-6-12-3-2-4-12)10-7-13-5-8-14-11-13/h12-14H,2-11H2,1H3
InChIKeyHDOWXFGJRIUATG-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.11
Rot. Bonds6

About 2-cyclobutyl-N-methyl-N-(2-pyrrolidin-3-ylethyl)ethanamine

2-cyclobutyl-N-methyl-N-(2-pyrrolidin-3-ylethyl)ethanamine (PubChem CID 115210939) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is 2-cyclobutyl-N-methyl-N-(2-pyrrolidin-3-ylethyl)ethanamine.

Molecular Properties

Compound Name2-cyclobutyl-N-methyl-N-(2-pyrrolidin-3-ylethyl)ethanamine
PubChem CID115210939
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC Name2-cyclobutyl-N-methyl-N-(2-pyrrolidin-3-ylethyl)ethanamine
SMILESCN(CCC1CCC1)CCC1CCNC1
InChIInChI=1S/C13H26N2/c1-15(9-6-12-3-2-4-12)10-7-13-5-8-14-11-13/h12-14H,2-11H2,1H3
InChIKeyHDOWXFGJRIUATG-UHFFFAOYSA-N
XLogP2.11
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclobutyl-N-methyl-N-(2-pyrrolidin-3-ylethyl)ethanamine?
The IUPAC name of 2-cyclobutyl-N-methyl-N-(2-pyrrolidin-3-ylethyl)ethanamine (CID 115210939) is 2-cyclobutyl-N-methyl-N-(2-pyrrolidin-3-ylethyl)ethanamine.
What is the SMILES notation for 2-cyclobutyl-N-methyl-N-(2-pyrrolidin-3-ylethyl)ethanamine?
The canonical SMILES for 2-cyclobutyl-N-methyl-N-(2-pyrrolidin-3-ylethyl)ethanamine is CN(CCC1CCC1)CCC1CCNC1.
What is the InChIKey of 2-cyclobutyl-N-methyl-N-(2-pyrrolidin-3-ylethyl)ethanamine?
The InChIKey is HDOWXFGJRIUATG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-15(9-6-12-3-2-4-12)10-7-13-5-8-14-11-13/h12-14H,2-11H2,1H3.
What are the key properties of 2-cyclobutyl-N-methyl-N-(2-pyrrolidin-3-ylethyl)ethanamine?
2-cyclobutyl-N-methyl-N-(2-pyrrolidin-3-ylethyl)ethanamine has a molecular weight of 210.36 g/mol, XLogP of 2.11, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclobutyl-N-methyl-N-(2-pyrrolidin-3-ylethyl)ethanamine is sourced from PubChem (CID 115210939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).