1-[1-[(5-ethyl-2-methylmorpholin-4-yl)methyl]cyclopentyl]-N-methylmethanamine

C15H30N2O — CID 55056063

IUPAC1-[1-[(5-ethyl-2-methylmorpholin-4-yl)methyl]cyclopentyl]-N-methylmethanamine
SMILESCCC1COC(C)CN1CC1(CNC)CCCC1
InChIInChI=1S/C15H30N2O/c1-4-14-10-18-13(2)9-17(14)12-15(11-16-3)7-5-6-8-15/h13-14,16H,4-12H2,1-3H3
InChIKeyIIKHPRPRZWYJJD-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.27
Rot. Bonds5

About 1-[1-[(5-ethyl-2-methylmorpholin-4-yl)methyl]cyclopentyl]-N-methylmethanamine

1-[1-[(5-ethyl-2-methylmorpholin-4-yl)methyl]cyclopentyl]-N-methylmethanamine (PubChem CID 55056063) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is 1-[1-[(5-ethyl-2-methylmorpholin-4-yl)methyl]cyclopentyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[1-[(5-ethyl-2-methylmorpholin-4-yl)methyl]cyclopentyl]-N-methylmethanamine
PubChem CID55056063
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name1-[1-[(5-ethyl-2-methylmorpholin-4-yl)methyl]cyclopentyl]-N-methylmethanamine
SMILESCCC1COC(C)CN1CC1(CNC)CCCC1
InChIInChI=1S/C15H30N2O/c1-4-14-10-18-13(2)9-17(14)12-15(11-16-3)7-5-6-8-15/h13-14,16H,4-12H2,1-3H3
InChIKeyIIKHPRPRZWYJJD-UHFFFAOYSA-N
XLogP2.27
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[1-[(5-ethyl-2-methylmorpholin-4-yl)methyl]cyclopentyl]-N-methylmethanamine?
The IUPAC name of 1-[1-[(5-ethyl-2-methylmorpholin-4-yl)methyl]cyclopentyl]-N-methylmethanamine (CID 55056063) is 1-[1-[(5-ethyl-2-methylmorpholin-4-yl)methyl]cyclopentyl]-N-methylmethanamine.
What is the SMILES notation for 1-[1-[(5-ethyl-2-methylmorpholin-4-yl)methyl]cyclopentyl]-N-methylmethanamine?
The canonical SMILES for 1-[1-[(5-ethyl-2-methylmorpholin-4-yl)methyl]cyclopentyl]-N-methylmethanamine is CCC1COC(C)CN1CC1(CNC)CCCC1.
What is the InChIKey of 1-[1-[(5-ethyl-2-methylmorpholin-4-yl)methyl]cyclopentyl]-N-methylmethanamine?
The InChIKey is IIKHPRPRZWYJJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-4-14-10-18-13(2)9-17(14)12-15(11-16-3)7-5-6-8-15/h13-14,16H,4-12H2,1-3H3.
What are the key properties of 1-[1-[(5-ethyl-2-methylmorpholin-4-yl)methyl]cyclopentyl]-N-methylmethanamine?
1-[1-[(5-ethyl-2-methylmorpholin-4-yl)methyl]cyclopentyl]-N-methylmethanamine has a molecular weight of 254.42 g/mol, XLogP of 2.27, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[(5-ethyl-2-methylmorpholin-4-yl)methyl]cyclopentyl]-N-methylmethanamine is sourced from PubChem (CID 55056063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).