4-propan-2-yl-2-[(2-propan-2-ylphenoxy)methyl]morpholine

C17H27NO2 — CID 64763487

IUPAC4-propan-2-yl-2-[(2-propan-2-ylphenoxy)methyl]morpholine
SMILESCC(C)c1ccccc1OCC1CN(C(C)C)CCO1
InChIInChI=1S/C17H27NO2/c1-13(2)16-7-5-6-8-17(16)20-12-15-11-18(14(3)4)9-10-19-15/h5-8,13-15H,9-12H2,1-4H3
InChIKeyCGMYPMJTGHSJOP-UHFFFAOYSA-N
MW277.41 g/mol
LogP3.30
Rot. Bonds5

About 4-propan-2-yl-2-[(2-propan-2-ylphenoxy)methyl]morpholine

4-propan-2-yl-2-[(2-propan-2-ylphenoxy)methyl]morpholine (PubChem CID 64763487) has the molecular formula C17H27NO2 and a molecular weight of 277.41 g/mol. Its IUPAC name is 4-propan-2-yl-2-[(2-propan-2-ylphenoxy)methyl]morpholine.

Molecular Properties

Compound Name4-propan-2-yl-2-[(2-propan-2-ylphenoxy)methyl]morpholine
PubChem CID64763487
Molecular FormulaC17H27NO2
Molecular Weight277.41 g/mol
Exact Mass277.20
IUPAC Name4-propan-2-yl-2-[(2-propan-2-ylphenoxy)methyl]morpholine
SMILESCC(C)c1ccccc1OCC1CN(C(C)C)CCO1
InChIInChI=1S/C17H27NO2/c1-13(2)16-7-5-6-8-17(16)20-12-15-11-18(14(3)4)9-10-19-15/h5-8,13-15H,9-12H2,1-4H3
InChIKeyCGMYPMJTGHSJOP-UHFFFAOYSA-N
XLogP3.30
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.41
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-propan-2-yl-2-[(2-propan-2-ylphenoxy)methyl]morpholine 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

2-[(2,3-dimethylphenoxy)methyl]-4-propan-2-ylmorpholine
CID 103432287
N-[1-[2-[(4-propan-2-ylmorpholin-2-yl)methoxy]phenyl]ethylidene]hydroxylamine
CID 77043440
2-(3H-inden-4-yloxymethyl)-4-propan-2-ylmorpholine
CID 12917370
2-[(3-methyl-1H-inden-4-yl)oxymethyl]-4-propan-2-ylmorpholine
CID 12800264
2-[(1-methyl-3H-inden-4-yl)oxymethyl]-4-propan-2-ylmorpholine
CID 12800263
(1S)-1-[5-methyl-2-[(4-propan-2-ylmorpholin-2-yl)methoxy]phenyl]ethanamine
CID 78996510
(1R)-1-[2-[(4-ethylmorpholin-2-yl)methoxy]phenyl]ethanol
CID 79171283
N-ethyl-1-[2-[(4-methylmorpholin-2-yl)methoxy]phenyl]ethanamine
CID 79171207
[5-fluoro-2-[(4-propan-2-ylmorpholin-2-yl)methoxy]phenyl]boronic acid
CID 64535556
(2-ethoxyphenyl)-(4-propan-2-ylmorpholin-2-yl)methanamine
CID 79664711
2-[(2-fluoro-5-methylphenoxy)methyl]-4-propan-2-ylmorpholine
CID 64854529
4-fluoro-2-[(4-propan-2-ylmorpholin-2-yl)methoxy]benzoic acid
CID 107014520

Frequently Asked Questions

What is the IUPAC name of 4-propan-2-yl-2-[(2-propan-2-ylphenoxy)methyl]morpholine?
The IUPAC name of 4-propan-2-yl-2-[(2-propan-2-ylphenoxy)methyl]morpholine (CID 64763487) is 4-propan-2-yl-2-[(2-propan-2-ylphenoxy)methyl]morpholine.
What is the SMILES notation for 4-propan-2-yl-2-[(2-propan-2-ylphenoxy)methyl]morpholine?
The canonical SMILES for 4-propan-2-yl-2-[(2-propan-2-ylphenoxy)methyl]morpholine is CC(C)c1ccccc1OCC1CN(C(C)C)CCO1.
What is the InChIKey of 4-propan-2-yl-2-[(2-propan-2-ylphenoxy)methyl]morpholine?
The InChIKey is CGMYPMJTGHSJOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27NO2/c1-13(2)16-7-5-6-8-17(16)20-12-15-11-18(14(3)4)9-10-19-15/h5-8,13-15H,9-12H2,1-4H3.
What are the key properties of 4-propan-2-yl-2-[(2-propan-2-ylphenoxy)methyl]morpholine?
4-propan-2-yl-2-[(2-propan-2-ylphenoxy)methyl]morpholine has a molecular weight of 277.41 g/mol, XLogP of 3.30, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propan-2-yl-2-[(2-propan-2-ylphenoxy)methyl]morpholine is sourced from PubChem (CID 64763487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).