N-[(4-ethylmorpholin-2-yl)methyl]-1-methylcyclopentan-1-amine

C13H26N2O — CID 79164858

IUPACN-[(4-ethylmorpholin-2-yl)methyl]-1-methylcyclopentan-1-amine
SMILESCCN1CCOC(CNC2(C)CCCC2)C1
InChIInChI=1S/C13H26N2O/c1-3-15-8-9-16-12(11-15)10-14-13(2)6-4-5-7-13/h12,14H,3-11H2,1-2H3
InChIKeyVZPBUDBMCRHYLI-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.63
Rot. Bonds4

About N-[(4-ethylmorpholin-2-yl)methyl]-1-methylcyclopentan-1-amine

N-[(4-ethylmorpholin-2-yl)methyl]-1-methylcyclopentan-1-amine (PubChem CID 79164858) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is N-[(4-ethylmorpholin-2-yl)methyl]-1-methylcyclopentan-1-amine.

Molecular Properties

Compound NameN-[(4-ethylmorpholin-2-yl)methyl]-1-methylcyclopentan-1-amine
PubChem CID79164858
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC NameN-[(4-ethylmorpholin-2-yl)methyl]-1-methylcyclopentan-1-amine
SMILESCCN1CCOC(CNC2(C)CCCC2)C1
InChIInChI=1S/C13H26N2O/c1-3-15-8-9-16-12(11-15)10-14-13(2)6-4-5-7-13/h12,14H,3-11H2,1-2H3
InChIKeyVZPBUDBMCRHYLI-UHFFFAOYSA-N
XLogP1.63
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 ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(4-ethylmorpholin-2-yl)methyl]-1-methylcyclopentan-1-amine?
The IUPAC name of N-[(4-ethylmorpholin-2-yl)methyl]-1-methylcyclopentan-1-amine (CID 79164858) is N-[(4-ethylmorpholin-2-yl)methyl]-1-methylcyclopentan-1-amine.
What is the SMILES notation for N-[(4-ethylmorpholin-2-yl)methyl]-1-methylcyclopentan-1-amine?
The canonical SMILES for N-[(4-ethylmorpholin-2-yl)methyl]-1-methylcyclopentan-1-amine is CCN1CCOC(CNC2(C)CCCC2)C1.
What is the InChIKey of N-[(4-ethylmorpholin-2-yl)methyl]-1-methylcyclopentan-1-amine?
The InChIKey is VZPBUDBMCRHYLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-3-15-8-9-16-12(11-15)10-14-13(2)6-4-5-7-13/h12,14H,3-11H2,1-2H3.
What are the key properties of N-[(4-ethylmorpholin-2-yl)methyl]-1-methylcyclopentan-1-amine?
N-[(4-ethylmorpholin-2-yl)methyl]-1-methylcyclopentan-1-amine has a molecular weight of 226.36 g/mol, XLogP of 1.63, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-ethylmorpholin-2-yl)methyl]-1-methylcyclopentan-1-amine is sourced from PubChem (CID 79164858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).