(2S,6R)-4-(2-cyclopropylphenyl)-2,6-dimethylmorpholine

C15H21NO — CID 126517774

IUPAC(2S,6R)-4-(2-cyclopropylphenyl)-2,6-dimethylmorpholine
SMILESC[C@@H]1CN(c2ccccc2C2CC2)C[C@H](C)O1
InChIInChI=1S/C15H21NO/c1-11-9-16(10-12(2)17-11)15-6-4-3-5-14(15)13-7-8-13/h3-6,11-13H,7-10H2,1-2H3/t11-,12+
InChIKeyQBHNYPJAENVODC-TXEJJXNPSA-N
MW231.34 g/mol
LogP3.18
Rot. Bonds2

About (2S,6R)-4-(2-cyclopropylphenyl)-2,6-dimethylmorpholine

(2S,6R)-4-(2-cyclopropylphenyl)-2,6-dimethylmorpholine (PubChem CID 126517774) has the molecular formula C15H21NO and a molecular weight of 231.34 g/mol. Its IUPAC name is (2S,6R)-4-(2-cyclopropylphenyl)-2,6-dimethylmorpholine.

Molecular Properties

Compound Name(2S,6R)-4-(2-cyclopropylphenyl)-2,6-dimethylmorpholine
PubChem CID126517774
Molecular FormulaC15H21NO
Molecular Weight231.34 g/mol
Exact Mass231.16
IUPAC Name(2S,6R)-4-(2-cyclopropylphenyl)-2,6-dimethylmorpholine
SMILESC[C@@H]1CN(c2ccccc2C2CC2)C[C@H](C)O1
InChIInChI=1S/C15H21NO/c1-11-9-16(10-12(2)17-11)15-6-4-3-5-14(15)13-7-8-13/h3-6,11-13H,7-10H2,1-2H3/t11-,12+
InChIKeyQBHNYPJAENVODC-TXEJJXNPSA-N
XLogP3.18
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze (2S,6R)-4-(2-cyclopropylphenyl)-2,6-dimethylmorpholine 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

1-(2-cyclopropylphenyl)pyrrolidine
CID 155600422
(2R,6R)-2,6-dimethyl-4-(2-nitrophenyl)morpholine
CID 7210197
2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]benzamide
CID 68507649
[2-(2,6-dimethylmorpholin-4-yl)phenyl]-diphenylphosphane
CID 145030339
(8R)-1-azatricyclo[6.2.1.02,7]undeca-2,4,6-triene
CID 101081502
2-(2,6-dimethylmorpholin-4-yl)benzenecarboximidamide
CID 43199936
tricyclo[6.2.2.02,7]dodeca-2,4,6-triene
CID 582301
2-(bromomethyl)-6-methyl-4-[2-(trifluoromethyl)phenyl]morpholine
CID 102937208
N-[[2-(2,6-dimethylmorpholin-4-yl)phenyl]methyl]-2-methylpropan-1-amine
CID 63058724
1-[2-(4-tert-butylcyclohexyl)phenyl]-4-methylpiperazine;hydrochloride
CID 23143135
4-(furan-2-yl)-2,6-dimethylmorpholine
CID 175415058
1-(cyclopropylmethyl)-3-[2-(2,6-dimethylmorpholin-4-yl)phenyl]urea
CID 51085659

Frequently Asked Questions

What is the IUPAC name of (2S,6R)-4-(2-cyclopropylphenyl)-2,6-dimethylmorpholine?
The IUPAC name of (2S,6R)-4-(2-cyclopropylphenyl)-2,6-dimethylmorpholine (CID 126517774) is (2S,6R)-4-(2-cyclopropylphenyl)-2,6-dimethylmorpholine.
What is the SMILES notation for (2S,6R)-4-(2-cyclopropylphenyl)-2,6-dimethylmorpholine?
The canonical SMILES for (2S,6R)-4-(2-cyclopropylphenyl)-2,6-dimethylmorpholine is C[C@@H]1CN(c2ccccc2C2CC2)C[C@H](C)O1.
What is the InChIKey of (2S,6R)-4-(2-cyclopropylphenyl)-2,6-dimethylmorpholine?
The InChIKey is QBHNYPJAENVODC-TXEJJXNPSA-N. The full InChI is InChI=1S/C15H21NO/c1-11-9-16(10-12(2)17-11)15-6-4-3-5-14(15)13-7-8-13/h3-6,11-13H,7-10H2,1-2H3/t11-,12+.
What are the key properties of (2S,6R)-4-(2-cyclopropylphenyl)-2,6-dimethylmorpholine?
(2S,6R)-4-(2-cyclopropylphenyl)-2,6-dimethylmorpholine has a molecular weight of 231.34 g/mol, XLogP of 3.18, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,6R)-4-(2-cyclopropylphenyl)-2,6-dimethylmorpholine is sourced from PubChem (CID 126517774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).