[1-(3-methylmorpholin-4-yl)-4-propylcyclohexyl]methanamine

C15H30N2O — CID 54932678

IUPAC[1-(3-methylmorpholin-4-yl)-4-propylcyclohexyl]methanamine
SMILESCCCC1CCC(CN)(N2CCOCC2C)CC1
InChIInChI=1S/C15H30N2O/c1-3-4-14-5-7-15(12-16,8-6-14)17-9-10-18-11-13(17)2/h13-14H,3-12,16H2,1-2H3
InChIKeyMJXOWPIAKIHYIZ-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.39
Rot. Bonds4

About [1-(3-methylmorpholin-4-yl)-4-propylcyclohexyl]methanamine

[1-(3-methylmorpholin-4-yl)-4-propylcyclohexyl]methanamine (PubChem CID 54932678) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is [1-(3-methylmorpholin-4-yl)-4-propylcyclohexyl]methanamine.

Molecular Properties

Compound Name[1-(3-methylmorpholin-4-yl)-4-propylcyclohexyl]methanamine
PubChem CID54932678
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name[1-(3-methylmorpholin-4-yl)-4-propylcyclohexyl]methanamine
SMILESCCCC1CCC(CN)(N2CCOCC2C)CC1
InChIInChI=1S/C15H30N2O/c1-3-4-14-5-7-15(12-16,8-6-14)17-9-10-18-11-13(17)2/h13-14H,3-12,16H2,1-2H3
InChIKeyMJXOWPIAKIHYIZ-UHFFFAOYSA-N
XLogP2.39
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1-(3-methylmorpholin-4-yl)-4-propylcyclohexyl]methanamine?
The IUPAC name of [1-(3-methylmorpholin-4-yl)-4-propylcyclohexyl]methanamine (CID 54932678) is [1-(3-methylmorpholin-4-yl)-4-propylcyclohexyl]methanamine.
What is the SMILES notation for [1-(3-methylmorpholin-4-yl)-4-propylcyclohexyl]methanamine?
The canonical SMILES for [1-(3-methylmorpholin-4-yl)-4-propylcyclohexyl]methanamine is CCCC1CCC(CN)(N2CCOCC2C)CC1.
What is the InChIKey of [1-(3-methylmorpholin-4-yl)-4-propylcyclohexyl]methanamine?
The InChIKey is MJXOWPIAKIHYIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-3-4-14-5-7-15(12-16,8-6-14)17-9-10-18-11-13(17)2/h13-14H,3-12,16H2,1-2H3.
What are the key properties of [1-(3-methylmorpholin-4-yl)-4-propylcyclohexyl]methanamine?
[1-(3-methylmorpholin-4-yl)-4-propylcyclohexyl]methanamine has a molecular weight of 254.42 g/mol, XLogP of 2.39, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-methylmorpholin-4-yl)-4-propylcyclohexyl]methanamine is sourced from PubChem (CID 54932678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).