(2R)-1-(3,3-dimethylmorpholin-4-yl)-2-hydroxypropan-1-one

C9H17NO3 — CID 126987422

IUPAC(2R)-1-(3,3-dimethylmorpholin-4-yl)-2-hydroxypropan-1-one
SMILESC[C@@H](O)C(=O)N1CCOCC1(C)C
InChIInChI=1S/C9H17NO3/c1-7(11)8(12)10-4-5-13-6-9(10,2)3/h7,11H,4-6H2,1-3H3/t7-/m1/s1
InChIKeyKMCIWKLXKKSZGM-SSDOTTSWSA-N
MW187.24 g/mol
LogP0.00
Rot. Bonds1

About (2R)-1-(3,3-dimethylmorpholin-4-yl)-2-hydroxypropan-1-one

(2R)-1-(3,3-dimethylmorpholin-4-yl)-2-hydroxypropan-1-one (PubChem CID 126987422) has the molecular formula C9H17NO3 and a molecular weight of 187.24 g/mol. Its IUPAC name is (2R)-1-(3,3-dimethylmorpholin-4-yl)-2-hydroxypropan-1-one.

Molecular Properties

Compound Name(2R)-1-(3,3-dimethylmorpholin-4-yl)-2-hydroxypropan-1-one
PubChem CID126987422
Molecular FormulaC9H17NO3
Molecular Weight187.24 g/mol
Exact Mass187.12
IUPAC Name(2R)-1-(3,3-dimethylmorpholin-4-yl)-2-hydroxypropan-1-one
SMILESC[C@@H](O)C(=O)N1CCOCC1(C)C
InChIInChI=1S/C9H17NO3/c1-7(11)8(12)10-4-5-13-6-9(10,2)3/h7,11H,4-6H2,1-3H3/t7-/m1/s1
InChIKeyKMCIWKLXKKSZGM-SSDOTTSWSA-N
XLogP0.00
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.24
LogP ≤ 50.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (2R)-1-(3,3-dimethylmorpholin-4-yl)-2-hydroxypropan-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

(2R)-2-amino-1-(3,3-dimethylmorpholin-4-yl)propan-1-one
CID 78973108
1-(3,3-dimethylmorpholin-4-yl)-2-methoxypropan-1-one
CID 48521768
2-amino-1-(3,3-dimethylmorpholin-4-yl)-4-methylpentan-1-one
CID 61430745
(2S)-2-amino-1-(3,3-dimethylmorpholin-4-yl)butan-1-one
CID 79022791
2-chloro-1-(3,3-dimethyl-1,4-oxazepan-4-yl)propan-1-one
CID 146095014
1-(3,3-dimethylmorpholin-4-yl)-2-(4-fluorophenyl)-3-methylbutan-1-one
CID 110313085
N-[(2S)-1-(3,3-dimethylmorpholin-4-yl)-1-oxopropan-2-yl]furan-3-carboxamide
CID 94815631
(2S)-2-amino-1-(3,3-dimethylmorpholin-4-yl)-4-methylsulfanylbutan-1-one
CID 61430245
N-ethyl-N,3,3-trimethylmorpholine-4-carboxamide
CID 116654558
1-(3,3-dimethylmorpholin-4-yl)-3-(4-fluorophenyl)-2-methylpropan-1-one
CID 48862252
(3,3-dimethylmorpholin-4-yl)-piperidin-1-ylmethanone
CID 115592934
2-amino-1-(3,3-dimethylmorpholin-4-yl)-5-methoxypentan-1-one
CID 81088420

Frequently Asked Questions

What is the IUPAC name of (2R)-1-(3,3-dimethylmorpholin-4-yl)-2-hydroxypropan-1-one?
The IUPAC name of (2R)-1-(3,3-dimethylmorpholin-4-yl)-2-hydroxypropan-1-one (CID 126987422) is (2R)-1-(3,3-dimethylmorpholin-4-yl)-2-hydroxypropan-1-one.
What is the SMILES notation for (2R)-1-(3,3-dimethylmorpholin-4-yl)-2-hydroxypropan-1-one?
The canonical SMILES for (2R)-1-(3,3-dimethylmorpholin-4-yl)-2-hydroxypropan-1-one is C[C@@H](O)C(=O)N1CCOCC1(C)C.
What is the InChIKey of (2R)-1-(3,3-dimethylmorpholin-4-yl)-2-hydroxypropan-1-one?
The InChIKey is KMCIWKLXKKSZGM-SSDOTTSWSA-N. The full InChI is InChI=1S/C9H17NO3/c1-7(11)8(12)10-4-5-13-6-9(10,2)3/h7,11H,4-6H2,1-3H3/t7-/m1/s1.
What are the key properties of (2R)-1-(3,3-dimethylmorpholin-4-yl)-2-hydroxypropan-1-one?
(2R)-1-(3,3-dimethylmorpholin-4-yl)-2-hydroxypropan-1-one has a molecular weight of 187.24 g/mol, XLogP of 0.00, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-(3,3-dimethylmorpholin-4-yl)-2-hydroxypropan-1-one is sourced from PubChem (CID 126987422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).