1-cyclopentyl-N-methyl-2-(3-methylmorpholin-4-yl)ethanamine

C13H26N2O — CID 104744784

IUPAC1-cyclopentyl-N-methyl-2-(3-methylmorpholin-4-yl)ethanamine
SMILESCNC(CN1CCOCC1C)C1CCCC1
InChIInChI=1S/C13H26N2O/c1-11-10-16-8-7-15(11)9-13(14-2)12-5-3-4-6-12/h11-14H,3-10H2,1-2H3
InChIKeyBYGRWHZBPDETQK-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.49
Rot. Bonds4

About 1-cyclopentyl-N-methyl-2-(3-methylmorpholin-4-yl)ethanamine

1-cyclopentyl-N-methyl-2-(3-methylmorpholin-4-yl)ethanamine (PubChem CID 104744784) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is 1-cyclopentyl-N-methyl-2-(3-methylmorpholin-4-yl)ethanamine.

Molecular Properties

Compound Name1-cyclopentyl-N-methyl-2-(3-methylmorpholin-4-yl)ethanamine
PubChem CID104744784
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name1-cyclopentyl-N-methyl-2-(3-methylmorpholin-4-yl)ethanamine
SMILESCNC(CN1CCOCC1C)C1CCCC1
InChIInChI=1S/C13H26N2O/c1-11-10-16-8-7-15(11)9-13(14-2)12-5-3-4-6-12/h11-14H,3-10H2,1-2H3
InChIKeyBYGRWHZBPDETQK-UHFFFAOYSA-N
XLogP1.49
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-N-methyl-2-(3-methylmorpholin-4-yl)ethanamine?
The IUPAC name of 1-cyclopentyl-N-methyl-2-(3-methylmorpholin-4-yl)ethanamine (CID 104744784) is 1-cyclopentyl-N-methyl-2-(3-methylmorpholin-4-yl)ethanamine.
What is the SMILES notation for 1-cyclopentyl-N-methyl-2-(3-methylmorpholin-4-yl)ethanamine?
The canonical SMILES for 1-cyclopentyl-N-methyl-2-(3-methylmorpholin-4-yl)ethanamine is CNC(CN1CCOCC1C)C1CCCC1.
What is the InChIKey of 1-cyclopentyl-N-methyl-2-(3-methylmorpholin-4-yl)ethanamine?
The InChIKey is BYGRWHZBPDETQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-11-10-16-8-7-15(11)9-13(14-2)12-5-3-4-6-12/h11-14H,3-10H2,1-2H3.
What are the key properties of 1-cyclopentyl-N-methyl-2-(3-methylmorpholin-4-yl)ethanamine?
1-cyclopentyl-N-methyl-2-(3-methylmorpholin-4-yl)ethanamine has a molecular weight of 226.36 g/mol, XLogP of 1.49, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-N-methyl-2-(3-methylmorpholin-4-yl)ethanamine is sourced from PubChem (CID 104744784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).