(2-hydroxyphenyl)-(3-methylmorpholin-4-yl)methanone

C12H15NO3 — CID 43429054

IUPAC(2-hydroxyphenyl)-(3-methylmorpholin-4-yl)methanone
SMILESCC1COCCN1C(=O)c1ccccc1O
InChIInChI=1S/C12H15NO3/c1-9-8-16-7-6-13(9)12(15)10-4-2-3-5-11(10)14/h2-5,9,14H,6-8H2,1H3
InChIKeyQVUUXPGYUCPGQX-UHFFFAOYSA-N
MW221.26 g/mol
LogP1.25
Rot. Bonds1

About (2-hydroxyphenyl)-(3-methylmorpholin-4-yl)methanone

(2-hydroxyphenyl)-(3-methylmorpholin-4-yl)methanone (PubChem CID 43429054) has the molecular formula C12H15NO3 and a molecular weight of 221.26 g/mol. Its IUPAC name is (2-hydroxyphenyl)-(3-methylmorpholin-4-yl)methanone.

Molecular Properties

Compound Name(2-hydroxyphenyl)-(3-methylmorpholin-4-yl)methanone
PubChem CID43429054
Molecular FormulaC12H15NO3
Molecular Weight221.26 g/mol
Exact Mass221.11
IUPAC Name(2-hydroxyphenyl)-(3-methylmorpholin-4-yl)methanone
SMILESCC1COCCN1C(=O)c1ccccc1O
InChIInChI=1S/C12H15NO3/c1-9-8-16-7-6-13(9)12(15)10-4-2-3-5-11(10)14/h2-5,9,14H,6-8H2,1H3
InChIKeyQVUUXPGYUCPGQX-UHFFFAOYSA-N
XLogP1.25
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (2-hydroxyphenyl)-(3-methylmorpholin-4-yl)methanone 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 (2-hydroxyphenyl)-(3-methylmorpholin-4-yl)methanone?
The IUPAC name of (2-hydroxyphenyl)-(3-methylmorpholin-4-yl)methanone (CID 43429054) is (2-hydroxyphenyl)-(3-methylmorpholin-4-yl)methanone.
What is the SMILES notation for (2-hydroxyphenyl)-(3-methylmorpholin-4-yl)methanone?
The canonical SMILES for (2-hydroxyphenyl)-(3-methylmorpholin-4-yl)methanone is CC1COCCN1C(=O)c1ccccc1O.
What is the InChIKey of (2-hydroxyphenyl)-(3-methylmorpholin-4-yl)methanone?
The InChIKey is QVUUXPGYUCPGQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO3/c1-9-8-16-7-6-13(9)12(15)10-4-2-3-5-11(10)14/h2-5,9,14H,6-8H2,1H3.
What are the key properties of (2-hydroxyphenyl)-(3-methylmorpholin-4-yl)methanone?
(2-hydroxyphenyl)-(3-methylmorpholin-4-yl)methanone has a molecular weight of 221.26 g/mol, XLogP of 1.25, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-hydroxyphenyl)-(3-methylmorpholin-4-yl)methanone is sourced from PubChem (CID 43429054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).