(2S)-2-[4-(2-chlorophenoxy)anilino]-2-phenylacetamide

C20H17ClN2O2 — CID 25344822

IUPAC(2S)-2-[4-(2-chlorophenoxy)anilino]-2-phenylacetamide
SMILESNC(=O)[C@@H](Nc1ccc(Oc2ccccc2Cl)cc1)c1ccccc1
InChIInChI=1S/C20H17ClN2O2/c21-17-8-4-5-9-18(17)25-16-12-10-15(11-13-16)23-19(20(22)24)14-6-2-1-3-7-14/h1-13,19,23H,(H2,22,24)/t19-/m0/s1
InChIKeyRILCECOVEOITJU-IBGZPJMESA-N
MW352.82 g/mol
LogP4.77
Rot. Bonds6

About (2S)-2-[4-(2-chlorophenoxy)anilino]-2-phenylacetamide

(2S)-2-[4-(2-chlorophenoxy)anilino]-2-phenylacetamide (PubChem CID 25344822) has the molecular formula C20H17ClN2O2 and a molecular weight of 352.82 g/mol. Its IUPAC name is (2S)-2-[4-(2-chlorophenoxy)anilino]-2-phenylacetamide.

Molecular Properties

Compound Name(2S)-2-[4-(2-chlorophenoxy)anilino]-2-phenylacetamide
PubChem CID25344822
Molecular FormulaC20H17ClN2O2
Molecular Weight352.82 g/mol
Exact Mass352.10
IUPAC Name(2S)-2-[4-(2-chlorophenoxy)anilino]-2-phenylacetamide
SMILESNC(=O)[C@@H](Nc1ccc(Oc2ccccc2Cl)cc1)c1ccccc1
InChIInChI=1S/C20H17ClN2O2/c21-17-8-4-5-9-18(17)25-16-12-10-15(11-13-16)23-19(20(22)24)14-6-2-1-3-7-14/h1-13,19,23H,(H2,22,24)/t19-/m0/s1
InChIKeyRILCECOVEOITJU-IBGZPJMESA-N
XLogP4.77
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.82
LogP ≤ 54.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-anilino-2-phenylacetamide;ethane
CID 142824395
[4-(2-chlorophenoxy)phenyl]thiourea
CID 13275077
(2S)-2-(4-ethylanilino)-2-phenylacetamide
CID 33403571
2-anilino-2-(3-chloro-4-methoxyphenyl)acetamide
CID 65026961
3-[4-(2-chlorophenoxy)phenyl]-2-phenylpropanoic acid
CID 22684959
(2R)-2-[4-(4-bromophenoxy)anilino]-N-carbamoyl-2-phenylacetamide
CID 25355237
2-(chloroamino)-2-phenylacetamide
CID 89152727
(2S)-2-(3-bromo-4-methoxyanilino)-2-phenylacetamide
CID 95623687
azane;1-chloro-2-phenoxybenzene
CID 68980819
(2S)-2-(3,5-dimethylanilino)-2-phenylacetamide
CID 25348784
methyl 4-(2-amino-1-anilino-2-oxoethyl)benzoate
CID 61005608
N-[4-(2-chlorophenoxy)phenyl]-3-methylbut-2-enamide
CID 17488433

Frequently Asked Questions

What is the IUPAC name of (2S)-2-[4-(2-chlorophenoxy)anilino]-2-phenylacetamide?
The IUPAC name of (2S)-2-[4-(2-chlorophenoxy)anilino]-2-phenylacetamide (CID 25344822) is (2S)-2-[4-(2-chlorophenoxy)anilino]-2-phenylacetamide.
What is the SMILES notation for (2S)-2-[4-(2-chlorophenoxy)anilino]-2-phenylacetamide?
The canonical SMILES for (2S)-2-[4-(2-chlorophenoxy)anilino]-2-phenylacetamide is NC(=O)[C@@H](Nc1ccc(Oc2ccccc2Cl)cc1)c1ccccc1.
What is the InChIKey of (2S)-2-[4-(2-chlorophenoxy)anilino]-2-phenylacetamide?
The InChIKey is RILCECOVEOITJU-IBGZPJMESA-N. The full InChI is InChI=1S/C20H17ClN2O2/c21-17-8-4-5-9-18(17)25-16-12-10-15(11-13-16)23-19(20(22)24)14-6-2-1-3-7-14/h1-13,19,23H,(H2,22,24)/t19-/m0/s1.
What are the key properties of (2S)-2-[4-(2-chlorophenoxy)anilino]-2-phenylacetamide?
(2S)-2-[4-(2-chlorophenoxy)anilino]-2-phenylacetamide has a molecular weight of 352.82 g/mol, XLogP of 4.77, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-[4-(2-chlorophenoxy)anilino]-2-phenylacetamide is sourced from PubChem (CID 25344822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).