(2S)-N-(3,5-dichlorophenyl)-2-[[(2R)-1-methoxypropan-2-yl]amino]-2-phenylacetamide

C18H20Cl2N2O2 — CID 7928811

IUPAC(2S)-N-(3,5-dichlorophenyl)-2-[[(2R)-1-methoxypropan-2-yl]amino]-2-phenylacetamide
SMILESCOC[C@@H](C)N[C@H](C(=O)Nc1cc(Cl)cc(Cl)c1)c1ccccc1
InChIInChI=1S/C18H20Cl2N2O2/c1-12(11-24-2)21-17(13-6-4-3-5-7-13)18(23)22-16-9-14(19)8-15(20)10-16/h3-10,12,17,21H,11H2,1-2H3,(H,22,23)/t12-,17+/m1/s1
InChIKeyAENGQDKVAWVOHV-PXAZEXFGSA-N
MW367.28 g/mol
LogP4.30
Rot. Bonds7

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

(2S)-N-(3,5-dichlorophenyl)-2-[[(2R)-1-methoxypropan-2-yl]amino]-2-phenylacetamide (PubChem CID 7928811) has the molecular formula C18H20Cl2N2O2 and a molecular weight of 367.28 g/mol. Its IUPAC name is (2S)-N-(3,5-dichlorophenyl)-2-[[(2R)-1-methoxypropan-2-yl]amino]-2-phenylacetamide.

Molecular Properties

Compound Name(2S)-N-(3,5-dichlorophenyl)-2-[[(2R)-1-methoxypropan-2-yl]amino]-2-phenylacetamide
PubChem CID7928811
Molecular FormulaC18H20Cl2N2O2
Molecular Weight367.28 g/mol
Exact Mass366.09
IUPAC Name(2S)-N-(3,5-dichlorophenyl)-2-[[(2R)-1-methoxypropan-2-yl]amino]-2-phenylacetamide
SMILESCOC[C@@H](C)N[C@H](C(=O)Nc1cc(Cl)cc(Cl)c1)c1ccccc1
InChIInChI=1S/C18H20Cl2N2O2/c1-12(11-24-2)21-17(13-6-4-3-5-7-13)18(23)22-16-9-14(19)8-15(20)10-16/h3-10,12,17,21H,11H2,1-2H3,(H,22,23)/t12-,17+/m1/s1
InChIKeyAENGQDKVAWVOHV-PXAZEXFGSA-N
XLogP4.30
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.28
LogP ≤ 54.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (2S)-N-(3,5-dichlorophenyl)-2-[[(2R)-1-methoxypropan-2-yl]amino]-2-phenylacetamide with MolForge

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Related Compounds

(2R)-N-(3-acetylphenyl)-2-[[(2R)-1-methoxypropan-2-yl]amino]-2-phenylacetamide
CID 2621450
(2S)-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[[(2R)-1-methoxypropan-2-yl]amino]-2-phenylacetamide
CID 2108183
(2S)-2-[[(2S)-1-methoxypropan-2-yl]amino]-2-phenylacetamide
CID 33406332
(2R)-N-(3,5-dichlorophenyl)-2-[[2-(methylamino)-2-oxoethyl]amino]-2-phenylacetamide
CID 8771892
[(2R)-1-(3,5-dichloroanilino)-1-oxopropan-2-yl] 3-phenylsulfanylpropanoate
CID 7843476
N-(3,5-dichlorophenyl)-2-phenyl-2-(prop-2-enylamino)acetamide
CID 4883750
(2S)-N-(3,5-dichlorophenyl)-2-phenyl-2-(prop-2-enylamino)acetamide
CID 2494683
[(2R)-1-(3,5-dichloroanilino)-1-oxopropan-2-yl] (2S)-2-phenylbutanoate
CID 7810987
N-(3,5-dichlorophenyl)-2-phenoxypropanamide
CID 2886890
[(1R)-2-[[(2S)-1-(3,5-dichloroanilino)-1-oxopropan-2-yl]azaniumyl]-1-phenylethyl]-dimethylazanium
CID 8852443
(2R)-N-(3,5-dichlorophenyl)-2-[[(2R)-2-(dimethylamino)-2-phenylethyl]amino]propanamide
CID 8852446
[(2S)-1-(3,5-dichloroanilino)-1-oxopropan-2-yl] 3-(4-chlorophenyl)sulfanylpropanoate
CID 2083836

Frequently Asked Questions

What is the IUPAC name of (2S)-N-(3,5-dichlorophenyl)-2-[[(2R)-1-methoxypropan-2-yl]amino]-2-phenylacetamide?
The IUPAC name of (2S)-N-(3,5-dichlorophenyl)-2-[[(2R)-1-methoxypropan-2-yl]amino]-2-phenylacetamide (CID 7928811) is (2S)-N-(3,5-dichlorophenyl)-2-[[(2R)-1-methoxypropan-2-yl]amino]-2-phenylacetamide.
What is the SMILES notation for (2S)-N-(3,5-dichlorophenyl)-2-[[(2R)-1-methoxypropan-2-yl]amino]-2-phenylacetamide?
The canonical SMILES for (2S)-N-(3,5-dichlorophenyl)-2-[[(2R)-1-methoxypropan-2-yl]amino]-2-phenylacetamide is COC[C@@H](C)N[C@H](C(=O)Nc1cc(Cl)cc(Cl)c1)c1ccccc1.
What is the InChIKey of (2S)-N-(3,5-dichlorophenyl)-2-[[(2R)-1-methoxypropan-2-yl]amino]-2-phenylacetamide?
The InChIKey is AENGQDKVAWVOHV-PXAZEXFGSA-N. The full InChI is InChI=1S/C18H20Cl2N2O2/c1-12(11-24-2)21-17(13-6-4-3-5-7-13)18(23)22-16-9-14(19)8-15(20)10-16/h3-10,12,17,21H,11H2,1-2H3,(H,22,23)/t12-,17+/m1/s1.
What are the key properties of (2S)-N-(3,5-dichlorophenyl)-2-[[(2R)-1-methoxypropan-2-yl]amino]-2-phenylacetamide?
(2S)-N-(3,5-dichlorophenyl)-2-[[(2R)-1-methoxypropan-2-yl]amino]-2-phenylacetamide has a molecular weight of 367.28 g/mol, XLogP of 4.30, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(3,5-dichlorophenyl)-2-[[(2R)-1-methoxypropan-2-yl]amino]-2-phenylacetamide is sourced from PubChem (CID 7928811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).