2-methyl-1-[(2R)-2-(4-methylpentyl)morpholin-4-yl]propan-1-one

C14H27NO2 — CID 95225161

IUPAC2-methyl-1-[(2R)-2-(4-methylpentyl)morpholin-4-yl]propan-1-one
SMILESCC(C)CCC[C@@H]1CN(C(=O)C(C)C)CCO1
InChIInChI=1S/C14H27NO2/c1-11(2)6-5-7-13-10-15(8-9-17-13)14(16)12(3)4/h11-13H,5-10H2,1-4H3/t13-/m1/s1
InChIKeyHBDARNUVIBVIGQ-CYBMUJFWSA-N
MW241.38 g/mol
LogP2.70
Rot. Bonds5

About 2-methyl-1-[(2R)-2-(4-methylpentyl)morpholin-4-yl]propan-1-one

2-methyl-1-[(2R)-2-(4-methylpentyl)morpholin-4-yl]propan-1-one (PubChem CID 95225161) has the molecular formula C14H27NO2 and a molecular weight of 241.38 g/mol. Its IUPAC name is 2-methyl-1-[(2R)-2-(4-methylpentyl)morpholin-4-yl]propan-1-one.

Molecular Properties

Compound Name2-methyl-1-[(2R)-2-(4-methylpentyl)morpholin-4-yl]propan-1-one
PubChem CID95225161
Molecular FormulaC14H27NO2
Molecular Weight241.38 g/mol
Exact Mass241.20
IUPAC Name2-methyl-1-[(2R)-2-(4-methylpentyl)morpholin-4-yl]propan-1-one
SMILESCC(C)CCC[C@@H]1CN(C(=O)C(C)C)CCO1
InChIInChI=1S/C14H27NO2/c1-11(2)6-5-7-13-10-15(8-9-17-13)14(16)12(3)4/h11-13H,5-10H2,1-4H3/t13-/m1/s1
InChIKeyHBDARNUVIBVIGQ-CYBMUJFWSA-N
XLogP2.70
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.38
LogP ≤ 52.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-methyl-1-[(2R)-2-(4-methylpentyl)morpholin-4-yl]propan-1-one 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-methyl-1-[(2S)-2-(methylaminomethyl)morpholin-4-yl]propan-1-one
CID 139553521
1-[(2R)-2-(4-methylpentyl)morpholin-4-yl]pent-4-en-1-one
CID 95123093
1-[(2R)-2-(4-methylpentyl)morpholine-4-carbonyl]cyclopropane-1-carboxamide
CID 25456655
(2,5-dimethylphenyl)-[(2R)-2-(4-methylpentyl)morpholin-4-yl]methanone
CID 95556503
2-methyl-1-[2-[(4-methylpiperidin-1-yl)methyl]morpholin-4-yl]propan-1-one
CID 42849216
(5-methoxyfuran-2-yl)-[2-(4-methylpentyl)morpholin-4-yl]methanone
CID 45182494
(2R)-2,4-bis(4-methylpentyl)morpholine
CID 149421762
(2-methoxy-6-methylphenyl)-[2-(4-methylpentyl)morpholin-4-yl]methanone
CID 56875364
2H-benzotriazol-5-yl-[(2R)-2-(4-methylpentyl)morpholin-4-yl]methanone
CID 42519260
1-[(2S)-2-butylmorpholin-4-yl]ethanone
CID 155354328
[2-(4-methylpentyl)morpholin-4-yl]-(2-pyridin-3-ylpyrimidin-5-yl)methanone
CID 56878736
[(2R)-2-(4-methylpentyl)morpholin-4-yl]-(2-pyridin-3-ylpyrimidin-5-yl)methanone
CID 95558114

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-[(2R)-2-(4-methylpentyl)morpholin-4-yl]propan-1-one?
The IUPAC name of 2-methyl-1-[(2R)-2-(4-methylpentyl)morpholin-4-yl]propan-1-one (CID 95225161) is 2-methyl-1-[(2R)-2-(4-methylpentyl)morpholin-4-yl]propan-1-one.
What is the SMILES notation for 2-methyl-1-[(2R)-2-(4-methylpentyl)morpholin-4-yl]propan-1-one?
The canonical SMILES for 2-methyl-1-[(2R)-2-(4-methylpentyl)morpholin-4-yl]propan-1-one is CC(C)CCC[C@@H]1CN(C(=O)C(C)C)CCO1.
What is the InChIKey of 2-methyl-1-[(2R)-2-(4-methylpentyl)morpholin-4-yl]propan-1-one?
The InChIKey is HBDARNUVIBVIGQ-CYBMUJFWSA-N. The full InChI is InChI=1S/C14H27NO2/c1-11(2)6-5-7-13-10-15(8-9-17-13)14(16)12(3)4/h11-13H,5-10H2,1-4H3/t13-/m1/s1.
What are the key properties of 2-methyl-1-[(2R)-2-(4-methylpentyl)morpholin-4-yl]propan-1-one?
2-methyl-1-[(2R)-2-(4-methylpentyl)morpholin-4-yl]propan-1-one has a molecular weight of 241.38 g/mol, XLogP of 2.70, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-[(2R)-2-(4-methylpentyl)morpholin-4-yl]propan-1-one is sourced from PubChem (CID 95225161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).