[4-[2-[4-(aminomethyl)phenoxy]ethyl]-5-methylmorpholin-2-yl]methanol

C15H24N2O3 — CID 81203796

IUPAC[4-[2-[4-(aminomethyl)phenoxy]ethyl]-5-methylmorpholin-2-yl]methanol
SMILESCC1COC(CO)CN1CCOc1ccc(CN)cc1
InChIInChI=1S/C15H24N2O3/c1-12-11-20-15(10-18)9-17(12)6-7-19-14-4-2-13(8-16)3-5-14/h2-5,12,15,18H,6-11,16H2,1H3
InChIKeyZNDWPBKEOCCBCH-UHFFFAOYSA-N
MW280.37 g/mol
LogP0.61
Rot. Bonds6

About [4-[2-[4-(aminomethyl)phenoxy]ethyl]-5-methylmorpholin-2-yl]methanol

[4-[2-[4-(aminomethyl)phenoxy]ethyl]-5-methylmorpholin-2-yl]methanol (PubChem CID 81203796) has the molecular formula C15H24N2O3 and a molecular weight of 280.37 g/mol. Its IUPAC name is [4-[2-[4-(aminomethyl)phenoxy]ethyl]-5-methylmorpholin-2-yl]methanol.

Molecular Properties

Compound Name[4-[2-[4-(aminomethyl)phenoxy]ethyl]-5-methylmorpholin-2-yl]methanol
PubChem CID81203796
Molecular FormulaC15H24N2O3
Molecular Weight280.37 g/mol
Exact Mass280.18
IUPAC Name[4-[2-[4-(aminomethyl)phenoxy]ethyl]-5-methylmorpholin-2-yl]methanol
SMILESCC1COC(CO)CN1CCOc1ccc(CN)cc1
InChIInChI=1S/C15H24N2O3/c1-12-11-20-15(10-18)9-17(12)6-7-19-14-4-2-13(8-16)3-5-14/h2-5,12,15,18H,6-11,16H2,1H3
InChIKeyZNDWPBKEOCCBCH-UHFFFAOYSA-N
XLogP0.61
TPSA67.95 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 50.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze [4-[2-[4-(aminomethyl)phenoxy]ethyl]-5-methylmorpholin-2-yl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [4-[2-[4-(aminomethyl)phenoxy]ethyl]-5-methylmorpholin-2-yl]methanol?
The IUPAC name of [4-[2-[4-(aminomethyl)phenoxy]ethyl]-5-methylmorpholin-2-yl]methanol (CID 81203796) is [4-[2-[4-(aminomethyl)phenoxy]ethyl]-5-methylmorpholin-2-yl]methanol.
What is the SMILES notation for [4-[2-[4-(aminomethyl)phenoxy]ethyl]-5-methylmorpholin-2-yl]methanol?
The canonical SMILES for [4-[2-[4-(aminomethyl)phenoxy]ethyl]-5-methylmorpholin-2-yl]methanol is CC1COC(CO)CN1CCOc1ccc(CN)cc1.
What is the InChIKey of [4-[2-[4-(aminomethyl)phenoxy]ethyl]-5-methylmorpholin-2-yl]methanol?
The InChIKey is ZNDWPBKEOCCBCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3/c1-12-11-20-15(10-18)9-17(12)6-7-19-14-4-2-13(8-16)3-5-14/h2-5,12,15,18H,6-11,16H2,1H3.
What are the key properties of [4-[2-[4-(aminomethyl)phenoxy]ethyl]-5-methylmorpholin-2-yl]methanol?
[4-[2-[4-(aminomethyl)phenoxy]ethyl]-5-methylmorpholin-2-yl]methanol has a molecular weight of 280.37 g/mol, XLogP of 0.61, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[2-[4-(aminomethyl)phenoxy]ethyl]-5-methylmorpholin-2-yl]methanol is sourced from PubChem (CID 81203796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).