(2S)-N-(3,5-dichlorophenyl)-2-[(3S)-3-methylpiperidin-1-yl]-2-phenylacetamide

C20H22Cl2N2O — CID 51673367

IUPAC(2S)-N-(3,5-dichlorophenyl)-2-[(3S)-3-methylpiperidin-1-yl]-2-phenylacetamide
SMILESC[C@H]1CCCN([C@H](C(=O)Nc2cc(Cl)cc(Cl)c2)c2ccccc2)C1
InChIInChI=1S/C20H22Cl2N2O/c1-14-6-5-9-24(13-14)19(15-7-3-2-4-8-15)20(25)23-18-11-16(21)10-17(22)12-18/h2-4,7-8,10-12,14,19H,5-6,9,13H2,1H3,(H,23,25)/t14-,19-/m0/s1
InChIKeyXLHQGNYHSBLDPS-LIRRHRJNSA-N
MW377.32 g/mol
LogP5.41
Rot. Bonds4

About (2S)-N-(3,5-dichlorophenyl)-2-[(3S)-3-methylpiperidin-1-yl]-2-phenylacetamide

(2S)-N-(3,5-dichlorophenyl)-2-[(3S)-3-methylpiperidin-1-yl]-2-phenylacetamide (PubChem CID 51673367) has the molecular formula C20H22Cl2N2O and a molecular weight of 377.32 g/mol. Its IUPAC name is (2S)-N-(3,5-dichlorophenyl)-2-[(3S)-3-methylpiperidin-1-yl]-2-phenylacetamide.

Molecular Properties

Compound Name(2S)-N-(3,5-dichlorophenyl)-2-[(3S)-3-methylpiperidin-1-yl]-2-phenylacetamide
PubChem CID51673367
Molecular FormulaC20H22Cl2N2O
Molecular Weight377.32 g/mol
Exact Mass376.11
IUPAC Name(2S)-N-(3,5-dichlorophenyl)-2-[(3S)-3-methylpiperidin-1-yl]-2-phenylacetamide
SMILESC[C@H]1CCCN([C@H](C(=O)Nc2cc(Cl)cc(Cl)c2)c2ccccc2)C1
InChIInChI=1S/C20H22Cl2N2O/c1-14-6-5-9-24(13-14)19(15-7-3-2-4-8-15)20(25)23-18-11-16(21)10-17(22)12-18/h2-4,7-8,10-12,14,19H,5-6,9,13H2,1H3,(H,23,25)/t14-,19-/m0/s1
InChIKeyXLHQGNYHSBLDPS-LIRRHRJNSA-N
XLogP5.41
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500377.32
LogP ≤ 55.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2S)-N-(3,5-dichlorophenyl)-2-[(3S)-3-methylpiperidin-1-yl]-2-phenylacetamide 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

(2S)-N-(3-chloro-4-methoxyphenyl)-2-[(3S)-3-methylpiperidin-1-yl]-2-phenylacetamide
CID 6598333
(2R)-N-(3-chloro-4-methoxyphenyl)-2-[(3S)-3-methylpiperidin-1-yl]-2-phenylacetamide
CID 2419129
(2S)-N-(3,5-dichlorophenyl)-2-phenyl-2-piperidin-1-ylacetamide
CID 2563626
N-(methylcarbamoyl)-2-(3-methylpiperidin-1-yl)-2-phenylacetamide
CID 51167810
(3S)-1-[(1S)-2-(3,5-dimethylanilino)-2-oxo-1-phenylethyl]piperidine-3-carboxamide
CID 9267870
2-(3,5-dimethylpiperidin-1-yl)-2-phenyl-N-(4-propan-2-ylphenyl)acetamide
CID 4130031
N-(4-chlorophenyl)-2-(3-methylpiperidin-1-yl)propanamide
CID 4824476
2-(1,3-benzodioxol-5-yl)-2-(3-methylpiperidin-1-yl)-N-(4-propan-2-ylphenyl)acetamide
CID 4135042
(3S)-1-[(1S)-2-(4-methylanilino)-2-oxo-1-phenylethyl]piperidine-3-carboxamide
CID 9304552
2-(3-methylpiperidin-1-yl)-N-(1-phenylethyl)propanamide
CID 46800680
(2S)-N-(2-chlorophenyl)-2-[(3R)-3-methylpiperidin-1-yl]propanamide
CID 9275425
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[3-(hydroxymethyl)piperidin-1-yl]-2-phenylacetamide
CID 112768856

Frequently Asked Questions

What is the IUPAC name of (2S)-N-(3,5-dichlorophenyl)-2-[(3S)-3-methylpiperidin-1-yl]-2-phenylacetamide?
The IUPAC name of (2S)-N-(3,5-dichlorophenyl)-2-[(3S)-3-methylpiperidin-1-yl]-2-phenylacetamide (CID 51673367) is (2S)-N-(3,5-dichlorophenyl)-2-[(3S)-3-methylpiperidin-1-yl]-2-phenylacetamide.
What is the SMILES notation for (2S)-N-(3,5-dichlorophenyl)-2-[(3S)-3-methylpiperidin-1-yl]-2-phenylacetamide?
The canonical SMILES for (2S)-N-(3,5-dichlorophenyl)-2-[(3S)-3-methylpiperidin-1-yl]-2-phenylacetamide is C[C@H]1CCCN([C@H](C(=O)Nc2cc(Cl)cc(Cl)c2)c2ccccc2)C1.
What is the InChIKey of (2S)-N-(3,5-dichlorophenyl)-2-[(3S)-3-methylpiperidin-1-yl]-2-phenylacetamide?
The InChIKey is XLHQGNYHSBLDPS-LIRRHRJNSA-N. The full InChI is InChI=1S/C20H22Cl2N2O/c1-14-6-5-9-24(13-14)19(15-7-3-2-4-8-15)20(25)23-18-11-16(21)10-17(22)12-18/h2-4,7-8,10-12,14,19H,5-6,9,13H2,1H3,(H,23,25)/t14-,19-/m0/s1.
What are the key properties of (2S)-N-(3,5-dichlorophenyl)-2-[(3S)-3-methylpiperidin-1-yl]-2-phenylacetamide?
(2S)-N-(3,5-dichlorophenyl)-2-[(3S)-3-methylpiperidin-1-yl]-2-phenylacetamide has a molecular weight of 377.32 g/mol, XLogP of 5.41, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(3,5-dichlorophenyl)-2-[(3S)-3-methylpiperidin-1-yl]-2-phenylacetamide is sourced from PubChem (CID 51673367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).