(4-ethylmorpholin-2-yl)-[3-(2-methylpropyl)phenyl]methanol

C17H27NO2 — CID 116543719

IUPAC(4-ethylmorpholin-2-yl)-[3-(2-methylpropyl)phenyl]methanol
SMILESCCN1CCOC(C(O)c2cccc(CC(C)C)c2)C1
InChIInChI=1S/C17H27NO2/c1-4-18-8-9-20-16(12-18)17(19)15-7-5-6-14(11-15)10-13(2)3/h5-7,11,13,16-17,19H,4,8-10,12H2,1-3H3
InChIKeyLYOBLVASMZGCIB-UHFFFAOYSA-N
MW277.41 g/mol
LogP2.64
Rot. Bonds5

About (4-ethylmorpholin-2-yl)-[3-(2-methylpropyl)phenyl]methanol

(4-ethylmorpholin-2-yl)-[3-(2-methylpropyl)phenyl]methanol (PubChem CID 116543719) has the molecular formula C17H27NO2 and a molecular weight of 277.41 g/mol. Its IUPAC name is (4-ethylmorpholin-2-yl)-[3-(2-methylpropyl)phenyl]methanol.

Molecular Properties

Compound Name(4-ethylmorpholin-2-yl)-[3-(2-methylpropyl)phenyl]methanol
PubChem CID116543719
Molecular FormulaC17H27NO2
Molecular Weight277.41 g/mol
Exact Mass277.20
IUPAC Name(4-ethylmorpholin-2-yl)-[3-(2-methylpropyl)phenyl]methanol
SMILESCCN1CCOC(C(O)c2cccc(CC(C)C)c2)C1
InChIInChI=1S/C17H27NO2/c1-4-18-8-9-20-16(12-18)17(19)15-7-5-6-14(11-15)10-13(2)3/h5-7,11,13,16-17,19H,4,8-10,12H2,1-3H3
InChIKeyLYOBLVASMZGCIB-UHFFFAOYSA-N
XLogP2.64
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.41
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (4-ethylmorpholin-2-yl)-[3-(2-methylpropyl)phenyl]methanol with MolForge

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

Launch Full Analysis

Related Compounds

(4-propylmorpholin-2-yl)-(3-propylphenyl)methanol
CID 116543720
[3-(2-methylpropyl)phenyl]-(oxan-2-yl)methanol
CID 115838200
2-(3-chlorophenyl)-1-(4-ethylmorpholin-2-yl)ethanol
CID 79666850
(R)-[(2R)-4-benzylmorpholin-2-yl]-phenylmethanol
CID 58997974
(R)-[(2S)-4-benzylmorpholin-2-yl]-phenylmethanol
CID 58997973
(4-ethylmorpholin-2-yl)-quinolin-6-ylmethanol
CID 81220754
(4-ethylmorpholin-2-yl)-thiophen-3-ylmethanol
CID 79667022
(4-methylmorpholin-2-yl)-[3-(2-methylpropyl)phenyl]methanamine
CID 116544706
2-(3-chlorophenyl)-1-(4-ethylmorpholin-2-yl)ethanamine
CID 79666362
1-(4-ethylmorpholin-2-yl)-2-(3-fluorophenyl)ethanamine
CID 79666865
2-(3,4-difluorophenyl)-1-(4-ethylmorpholin-2-yl)ethanol
CID 82919753
2-(4-chlorophenyl)-1-(4-ethylmorpholin-2-yl)ethanol
CID 79666603

Frequently Asked Questions

What is the IUPAC name of (4-ethylmorpholin-2-yl)-[3-(2-methylpropyl)phenyl]methanol?
The IUPAC name of (4-ethylmorpholin-2-yl)-[3-(2-methylpropyl)phenyl]methanol (CID 116543719) is (4-ethylmorpholin-2-yl)-[3-(2-methylpropyl)phenyl]methanol.
What is the SMILES notation for (4-ethylmorpholin-2-yl)-[3-(2-methylpropyl)phenyl]methanol?
The canonical SMILES for (4-ethylmorpholin-2-yl)-[3-(2-methylpropyl)phenyl]methanol is CCN1CCOC(C(O)c2cccc(CC(C)C)c2)C1.
What is the InChIKey of (4-ethylmorpholin-2-yl)-[3-(2-methylpropyl)phenyl]methanol?
The InChIKey is LYOBLVASMZGCIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27NO2/c1-4-18-8-9-20-16(12-18)17(19)15-7-5-6-14(11-15)10-13(2)3/h5-7,11,13,16-17,19H,4,8-10,12H2,1-3H3.
What are the key properties of (4-ethylmorpholin-2-yl)-[3-(2-methylpropyl)phenyl]methanol?
(4-ethylmorpholin-2-yl)-[3-(2-methylpropyl)phenyl]methanol has a molecular weight of 277.41 g/mol, XLogP of 2.64, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethylmorpholin-2-yl)-[3-(2-methylpropyl)phenyl]methanol is sourced from PubChem (CID 116543719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).