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

C14H22N2O3 — CID 81202906

IUPAC[4-[2-[4-(aminomethyl)phenoxy]ethyl]morpholin-2-yl]methanol
SMILESNCc1ccc(OCCN2CCOC(CO)C2)cc1
InChIInChI=1S/C14H22N2O3/c15-9-12-1-3-13(4-2-12)18-7-5-16-6-8-19-14(10-16)11-17/h1-4,14,17H,5-11,15H2
InChIKeyLGXFASORIMMCRV-UHFFFAOYSA-N
MW266.34 g/mol
LogP0.22
Rot. Bonds6

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

[4-[2-[4-(aminomethyl)phenoxy]ethyl]morpholin-2-yl]methanol (PubChem CID 81202906) has the molecular formula C14H22N2O3 and a molecular weight of 266.34 g/mol. Its IUPAC name is [4-[2-[4-(aminomethyl)phenoxy]ethyl]morpholin-2-yl]methanol.

Molecular Properties

Compound Name[4-[2-[4-(aminomethyl)phenoxy]ethyl]morpholin-2-yl]methanol
PubChem CID81202906
Molecular FormulaC14H22N2O3
Molecular Weight266.34 g/mol
Exact Mass266.16
IUPAC Name[4-[2-[4-(aminomethyl)phenoxy]ethyl]morpholin-2-yl]methanol
SMILESNCc1ccc(OCCN2CCOC(CO)C2)cc1
InChIInChI=1S/C14H22N2O3/c15-9-12-1-3-13(4-2-12)18-7-5-16-6-8-19-14(10-16)11-17/h1-4,14,17H,5-11,15H2
InChIKeyLGXFASORIMMCRV-UHFFFAOYSA-N
XLogP0.22
TPSA67.95 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 50.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [4-[2-[4-(aminomethyl)phenoxy]ethyl]morpholin-2-yl]methanol?
The IUPAC name of [4-[2-[4-(aminomethyl)phenoxy]ethyl]morpholin-2-yl]methanol (CID 81202906) is [4-[2-[4-(aminomethyl)phenoxy]ethyl]morpholin-2-yl]methanol.
What is the SMILES notation for [4-[2-[4-(aminomethyl)phenoxy]ethyl]morpholin-2-yl]methanol?
The canonical SMILES for [4-[2-[4-(aminomethyl)phenoxy]ethyl]morpholin-2-yl]methanol is NCc1ccc(OCCN2CCOC(CO)C2)cc1.
What is the InChIKey of [4-[2-[4-(aminomethyl)phenoxy]ethyl]morpholin-2-yl]methanol?
The InChIKey is LGXFASORIMMCRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O3/c15-9-12-1-3-13(4-2-12)18-7-5-16-6-8-19-14(10-16)11-17/h1-4,14,17H,5-11,15H2.
What are the key properties of [4-[2-[4-(aminomethyl)phenoxy]ethyl]morpholin-2-yl]methanol?
[4-[2-[4-(aminomethyl)phenoxy]ethyl]morpholin-2-yl]methanol has a molecular weight of 266.34 g/mol, XLogP of 0.22, 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]morpholin-2-yl]methanol is sourced from PubChem (CID 81202906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).