[4-(5-ethyl-2-methylmorpholin-4-yl)-3-methylphenyl]methanamine

C15H24N2O — CID 60929563

IUPAC[4-(5-ethyl-2-methylmorpholin-4-yl)-3-methylphenyl]methanamine
SMILESCCC1COC(C)CN1c1ccc(CN)cc1C
InChIInChI=1S/C15H24N2O/c1-4-14-10-18-12(3)9-17(14)15-6-5-13(8-16)7-11(15)2/h5-7,12,14H,4,8-10,16H2,1-3H3
InChIKeyGTZRIKBYFIQFHB-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.46
Rot. Bonds3

About [4-(5-ethyl-2-methylmorpholin-4-yl)-3-methylphenyl]methanamine

[4-(5-ethyl-2-methylmorpholin-4-yl)-3-methylphenyl]methanamine (PubChem CID 60929563) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is [4-(5-ethyl-2-methylmorpholin-4-yl)-3-methylphenyl]methanamine.

Molecular Properties

Compound Name[4-(5-ethyl-2-methylmorpholin-4-yl)-3-methylphenyl]methanamine
PubChem CID60929563
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name[4-(5-ethyl-2-methylmorpholin-4-yl)-3-methylphenyl]methanamine
SMILESCCC1COC(C)CN1c1ccc(CN)cc1C
InChIInChI=1S/C15H24N2O/c1-4-14-10-18-12(3)9-17(14)15-6-5-13(8-16)7-11(15)2/h5-7,12,14H,4,8-10,16H2,1-3H3
InChIKeyGTZRIKBYFIQFHB-UHFFFAOYSA-N
XLogP2.46
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [4-(5-ethyl-2-methylmorpholin-4-yl)-3-methylphenyl]methanamine?
The IUPAC name of [4-(5-ethyl-2-methylmorpholin-4-yl)-3-methylphenyl]methanamine (CID 60929563) is [4-(5-ethyl-2-methylmorpholin-4-yl)-3-methylphenyl]methanamine.
What is the SMILES notation for [4-(5-ethyl-2-methylmorpholin-4-yl)-3-methylphenyl]methanamine?
The canonical SMILES for [4-(5-ethyl-2-methylmorpholin-4-yl)-3-methylphenyl]methanamine is CCC1COC(C)CN1c1ccc(CN)cc1C.
What is the InChIKey of [4-(5-ethyl-2-methylmorpholin-4-yl)-3-methylphenyl]methanamine?
The InChIKey is GTZRIKBYFIQFHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-4-14-10-18-12(3)9-17(14)15-6-5-13(8-16)7-11(15)2/h5-7,12,14H,4,8-10,16H2,1-3H3.
What are the key properties of [4-(5-ethyl-2-methylmorpholin-4-yl)-3-methylphenyl]methanamine?
[4-(5-ethyl-2-methylmorpholin-4-yl)-3-methylphenyl]methanamine has a molecular weight of 248.37 g/mol, XLogP of 2.46, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(5-ethyl-2-methylmorpholin-4-yl)-3-methylphenyl]methanamine is sourced from PubChem (CID 60929563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).