(2S)-2-(2,4-dichlorophenyl)-N-[(1R,2R)-2-methylcyclohexyl]-2-morpholin-4-ylacetamide

C19H26Cl2N2O2 — CID 100899496

IUPAC(2S)-2-(2,4-dichlorophenyl)-N-[(1R,2R)-2-methylcyclohexyl]-2-morpholin-4-ylacetamide
SMILESC[C@@H]1CCCC[C@H]1NC(=O)[C@H](c1ccc(Cl)cc1Cl)N1CCOCC1
InChIInChI=1S/C19H26Cl2N2O2/c1-13-4-2-3-5-17(13)22-19(24)18(23-8-10-25-11-9-23)15-7-6-14(20)12-16(15)21/h6-7,12-13,17-18H,2-5,8-11H2,1H3,(H,22,24)/t13-,17-,18+/m1/s1
InChIKeySDOCKBNRWXASIE-XWIAVFTESA-N
MW385.34 g/mol
LogP4.06
Rot. Bonds4

About (2S)-2-(2,4-dichlorophenyl)-N-[(1R,2R)-2-methylcyclohexyl]-2-morpholin-4-ylacetamide

(2S)-2-(2,4-dichlorophenyl)-N-[(1R,2R)-2-methylcyclohexyl]-2-morpholin-4-ylacetamide (PubChem CID 100899496) has the molecular formula C19H26Cl2N2O2 and a molecular weight of 385.34 g/mol. Its IUPAC name is (2S)-2-(2,4-dichlorophenyl)-N-[(1R,2R)-2-methylcyclohexyl]-2-morpholin-4-ylacetamide.

Molecular Properties

Compound Name(2S)-2-(2,4-dichlorophenyl)-N-[(1R,2R)-2-methylcyclohexyl]-2-morpholin-4-ylacetamide
PubChem CID100899496
Molecular FormulaC19H26Cl2N2O2
Molecular Weight385.34 g/mol
Exact Mass384.14
IUPAC Name(2S)-2-(2,4-dichlorophenyl)-N-[(1R,2R)-2-methylcyclohexyl]-2-morpholin-4-ylacetamide
SMILESC[C@@H]1CCCC[C@H]1NC(=O)[C@H](c1ccc(Cl)cc1Cl)N1CCOCC1
InChIInChI=1S/C19H26Cl2N2O2/c1-13-4-2-3-5-17(13)22-19(24)18(23-8-10-25-11-9-23)15-7-6-14(20)12-16(15)21/h6-7,12-13,17-18H,2-5,8-11H2,1H3,(H,22,24)/t13-,17-,18+/m1/s1
InChIKeySDOCKBNRWXASIE-XWIAVFTESA-N
XLogP4.06
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.34
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (2S)-2-(2,4-dichlorophenyl)-N-[(1R,2R)-2-methylcyclohexyl]-2-morpholin-4-ylacetamide 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-(2,4-dichlorophenyl)-N-(6-fluoro-2,3-dihydro-1H-inden-1-yl)-2-morpholin-4-ylacetamide
CID 166231646
4-[[2-(2,4-dichlorophenyl)-2-morpholin-4-ylacetyl]amino]butanoic acid
CID 119352757
[(1S)-1-(2,4-dichlorophenyl)ethyl]-[2-[[(1R,2R)-2-methylcyclohexyl]amino]-2-oxoethyl]azanium
CID 8594454
(2S)-N-[3-(carbamoylamino)phenyl]-2-(2,4-dichlorophenyl)-2-morpholin-4-ylacetamide
CID 97217806
2-(2,4-dichlorophenyl)-N-(2-methylimidazo[1,2-a]pyridin-6-yl)-2-morpholin-4-ylacetamide
CID 139005024
(2S)-2-(2,4-dichlorophenyl)-N-(2-methyl-1,3-benzoxazol-5-yl)-2-morpholin-4-ylacetamide
CID 97009143
2-(2,4-dichlorophenyl)-N-(2,6-dimethylphenyl)-2-piperidin-1-ylacetamide
CID 3108201
(2S)-N-benzyl-2-(2,4-dichlorophenyl)-N-methyl-2-morpholin-4-ylacetamide
CID 95781081
2-(2,4-dichlorophenyl)-N-(3-methyl-2H-pyrazolo[3,4-b]pyridin-5-yl)-2-morpholin-4-ylacetamide
CID 138995622
(2R)-2-[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]-N-[(1R,2R)-2-methylcyclohexyl]propanamide
CID 8757891
[(2S)-1-[[(1R,2S)-2-methylcyclohexyl]amino]-1-oxopropan-2-yl] 2-fluoro-5-morpholin-4-ylsulfonylbenzoate
CID 98869513
[1-[(2-methylcyclohexyl)amino]-1-oxopropan-2-yl] 4-fluoro-3-morpholin-4-ylsulfonylbenzoate
CID 42972405

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(2,4-dichlorophenyl)-N-[(1R,2R)-2-methylcyclohexyl]-2-morpholin-4-ylacetamide?
The IUPAC name of (2S)-2-(2,4-dichlorophenyl)-N-[(1R,2R)-2-methylcyclohexyl]-2-morpholin-4-ylacetamide (CID 100899496) is (2S)-2-(2,4-dichlorophenyl)-N-[(1R,2R)-2-methylcyclohexyl]-2-morpholin-4-ylacetamide.
What is the SMILES notation for (2S)-2-(2,4-dichlorophenyl)-N-[(1R,2R)-2-methylcyclohexyl]-2-morpholin-4-ylacetamide?
The canonical SMILES for (2S)-2-(2,4-dichlorophenyl)-N-[(1R,2R)-2-methylcyclohexyl]-2-morpholin-4-ylacetamide is C[C@@H]1CCCC[C@H]1NC(=O)[C@H](c1ccc(Cl)cc1Cl)N1CCOCC1.
What is the InChIKey of (2S)-2-(2,4-dichlorophenyl)-N-[(1R,2R)-2-methylcyclohexyl]-2-morpholin-4-ylacetamide?
The InChIKey is SDOCKBNRWXASIE-XWIAVFTESA-N. The full InChI is InChI=1S/C19H26Cl2N2O2/c1-13-4-2-3-5-17(13)22-19(24)18(23-8-10-25-11-9-23)15-7-6-14(20)12-16(15)21/h6-7,12-13,17-18H,2-5,8-11H2,1H3,(H,22,24)/t13-,17-,18+/m1/s1.
What are the key properties of (2S)-2-(2,4-dichlorophenyl)-N-[(1R,2R)-2-methylcyclohexyl]-2-morpholin-4-ylacetamide?
(2S)-2-(2,4-dichlorophenyl)-N-[(1R,2R)-2-methylcyclohexyl]-2-morpholin-4-ylacetamide has a molecular weight of 385.34 g/mol, XLogP of 4.06, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(2,4-dichlorophenyl)-N-[(1R,2R)-2-methylcyclohexyl]-2-morpholin-4-ylacetamide is sourced from PubChem (CID 100899496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).