[5-methyl-4-(1-phenylethyl)morpholin-2-yl]methanamine

C14H22N2O — CID 81218045

IUPAC[5-methyl-4-(1-phenylethyl)morpholin-2-yl]methanamine
SMILESCC1COC(CN)CN1C(C)c1ccccc1
InChIInChI=1S/C14H22N2O/c1-11-10-17-14(8-15)9-16(11)12(2)13-6-4-3-5-7-13/h3-7,11-12,14H,8-10,15H2,1-2H3
InChIKeyKAJDNPWBNNWTTR-UHFFFAOYSA-N
MW234.34 g/mol
LogP1.80
Rot. Bonds3

About [5-methyl-4-(1-phenylethyl)morpholin-2-yl]methanamine

[5-methyl-4-(1-phenylethyl)morpholin-2-yl]methanamine (PubChem CID 81218045) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is [5-methyl-4-(1-phenylethyl)morpholin-2-yl]methanamine.

Molecular Properties

Compound Name[5-methyl-4-(1-phenylethyl)morpholin-2-yl]methanamine
PubChem CID81218045
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name[5-methyl-4-(1-phenylethyl)morpholin-2-yl]methanamine
SMILESCC1COC(CN)CN1C(C)c1ccccc1
InChIInChI=1S/C14H22N2O/c1-11-10-17-14(8-15)9-16(11)12(2)13-6-4-3-5-7-13/h3-7,11-12,14H,8-10,15H2,1-2H3
InChIKeyKAJDNPWBNNWTTR-UHFFFAOYSA-N
XLogP1.80
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [5-methyl-4-(1-phenylethyl)morpholin-2-yl]methanamine?
The IUPAC name of [5-methyl-4-(1-phenylethyl)morpholin-2-yl]methanamine (CID 81218045) is [5-methyl-4-(1-phenylethyl)morpholin-2-yl]methanamine.
What is the SMILES notation for [5-methyl-4-(1-phenylethyl)morpholin-2-yl]methanamine?
The canonical SMILES for [5-methyl-4-(1-phenylethyl)morpholin-2-yl]methanamine is CC1COC(CN)CN1C(C)c1ccccc1.
What is the InChIKey of [5-methyl-4-(1-phenylethyl)morpholin-2-yl]methanamine?
The InChIKey is KAJDNPWBNNWTTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-11-10-17-14(8-15)9-16(11)12(2)13-6-4-3-5-7-13/h3-7,11-12,14H,8-10,15H2,1-2H3.
What are the key properties of [5-methyl-4-(1-phenylethyl)morpholin-2-yl]methanamine?
[5-methyl-4-(1-phenylethyl)morpholin-2-yl]methanamine has a molecular weight of 234.34 g/mol, XLogP of 1.80, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-methyl-4-(1-phenylethyl)morpholin-2-yl]methanamine is sourced from PubChem (CID 81218045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).