(2S)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N-[(1R,2S)-2-methylcyclohexyl]propanamide

C16H30N2O2 — CID 27066278

IUPAC(2S)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N-[(1R,2S)-2-methylcyclohexyl]propanamide
SMILESC[C@@H]1CN([C@@H](C)C(=O)N[C@@H]2CCCC[C@@H]2C)C[C@H](C)O1
InChIInChI=1S/C16H30N2O2/c1-11-7-5-6-8-15(11)17-16(19)14(4)18-9-12(2)20-13(3)10-18/h11-15H,5-10H2,1-4H3,(H,17,19)/t11-,12-,13+,14-,15+/m0/s1
InChIKeyWOFFVVZZCUXLEF-SBJFKYEJSA-N
MW282.43 g/mol
LogP2.18
Rot. Bonds3

About (2S)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N-[(1R,2S)-2-methylcyclohexyl]propanamide

(2S)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N-[(1R,2S)-2-methylcyclohexyl]propanamide (PubChem CID 27066278) has the molecular formula C16H30N2O2 and a molecular weight of 282.43 g/mol. Its IUPAC name is (2S)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N-[(1R,2S)-2-methylcyclohexyl]propanamide.

Molecular Properties

Compound Name(2S)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N-[(1R,2S)-2-methylcyclohexyl]propanamide
PubChem CID27066278
Molecular FormulaC16H30N2O2
Molecular Weight282.43 g/mol
Exact Mass282.23
IUPAC Name(2S)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N-[(1R,2S)-2-methylcyclohexyl]propanamide
SMILESC[C@@H]1CN([C@@H](C)C(=O)N[C@@H]2CCCC[C@@H]2C)C[C@H](C)O1
InChIInChI=1S/C16H30N2O2/c1-11-7-5-6-8-15(11)17-16(19)14(4)18-9-12(2)20-13(3)10-18/h11-15H,5-10H2,1-4H3,(H,17,19)/t11-,12-,13+,14-,15+/m0/s1
InChIKeyWOFFVVZZCUXLEF-SBJFKYEJSA-N
XLogP2.18
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (2S)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N-[(1R,2S)-2-methylcyclohexyl]propanamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2S)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N-[(1R,2S)-2-methylcyclohexyl]propanamide?
The IUPAC name of (2S)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N-[(1R,2S)-2-methylcyclohexyl]propanamide (CID 27066278) is (2S)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N-[(1R,2S)-2-methylcyclohexyl]propanamide.
What is the SMILES notation for (2S)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N-[(1R,2S)-2-methylcyclohexyl]propanamide?
The canonical SMILES for (2S)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N-[(1R,2S)-2-methylcyclohexyl]propanamide is C[C@@H]1CN([C@@H](C)C(=O)N[C@@H]2CCCC[C@@H]2C)C[C@H](C)O1.
What is the InChIKey of (2S)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N-[(1R,2S)-2-methylcyclohexyl]propanamide?
The InChIKey is WOFFVVZZCUXLEF-SBJFKYEJSA-N. The full InChI is InChI=1S/C16H30N2O2/c1-11-7-5-6-8-15(11)17-16(19)14(4)18-9-12(2)20-13(3)10-18/h11-15H,5-10H2,1-4H3,(H,17,19)/t11-,12-,13+,14-,15+/m0/s1.
What are the key properties of (2S)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N-[(1R,2S)-2-methylcyclohexyl]propanamide?
(2S)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N-[(1R,2S)-2-methylcyclohexyl]propanamide has a molecular weight of 282.43 g/mol, XLogP of 2.18, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N-[(1R,2S)-2-methylcyclohexyl]propanamide is sourced from PubChem (CID 27066278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).