(2S)-N-(3-chlorophenyl)-2-(4-chlorophenyl)-2-formamidoacetamide

C15H12Cl2N2O2 — CID 685016

IUPAC(2S)-N-(3-chlorophenyl)-2-(4-chlorophenyl)-2-formamidoacetamide
SMILESO=CN[C@H](C(=O)Nc1cccc(Cl)c1)c1ccc(Cl)cc1
InChIInChI=1S/C15H12Cl2N2O2/c16-11-6-4-10(5-7-11)14(18-9-20)15(21)19-13-3-1-2-12(17)8-13/h1-9,14H,(H,18,20)(H,19,21)/t14-/m0/s1
InChIKeyMUDNXFQWXNERGQ-AWEZNQCLSA-N
MW323.18 g/mol
LogP3.42
Rot. Bonds5

About (2S)-N-(3-chlorophenyl)-2-(4-chlorophenyl)-2-formamidoacetamide

(2S)-N-(3-chlorophenyl)-2-(4-chlorophenyl)-2-formamidoacetamide (PubChem CID 685016) has the molecular formula C15H12Cl2N2O2 and a molecular weight of 323.18 g/mol. Its IUPAC name is (2S)-N-(3-chlorophenyl)-2-(4-chlorophenyl)-2-formamidoacetamide.

Molecular Properties

Compound Name(2S)-N-(3-chlorophenyl)-2-(4-chlorophenyl)-2-formamidoacetamide
PubChem CID685016
Molecular FormulaC15H12Cl2N2O2
Molecular Weight323.18 g/mol
Exact Mass322.03
IUPAC Name(2S)-N-(3-chlorophenyl)-2-(4-chlorophenyl)-2-formamidoacetamide
SMILESO=CN[C@H](C(=O)Nc1cccc(Cl)c1)c1ccc(Cl)cc1
InChIInChI=1S/C15H12Cl2N2O2/c16-11-6-4-10(5-7-11)14(18-9-20)15(21)19-13-3-1-2-12(17)8-13/h1-9,14H,(H,18,20)(H,19,21)/t14-/m0/s1
InChIKeyMUDNXFQWXNERGQ-AWEZNQCLSA-N
XLogP3.42
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.18
LogP ≤ 53.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

(2R)-2-formamido-N,2-diphenylacetamide
CID 167282535
N-[2-(3-chloroanilino)-1-(4-chlorophenyl)-2-oxoethyl]quinoline-2-carboxamide
CID 23796306
(2S)-2-chloro-N-(3-chlorophenyl)propanamide
CID 2404784
3-[[2,2-bis(4-chlorophenyl)acetyl]amino]benzoate
CID 5008293
(2S,3S)-2,3-dichloro-N-(3-chlorophenyl)butanamide
CID 7385868
N-(3-chlorophenyl)-2-methylbutanamide
CID 4636150
(2R,3S)-2,3-dichloro-N-(3-chlorophenyl)butanamide
CID 7385866
N'-(3-chlorophenyl)-N-(4-propan-2-ylphenyl)oxamide
CID 44996296
[(2S)-1-(3-chloroanilino)-1-oxopropan-2-yl] 4-chlorobenzoate
CID 2629142
N-(3-chlorophenyl)-4-propan-2-ylbenzamide
CID 1406456
(2S)-2-anilino-N-(3-chlorophenyl)propanamide
CID 7928382
(2S)-N-(3-chlorophenyl)-2-(4-chlorophenyl)sulfanylbutanamide
CID 92674766

Frequently Asked Questions

What is the IUPAC name of (2S)-N-(3-chlorophenyl)-2-(4-chlorophenyl)-2-formamidoacetamide?
The IUPAC name of (2S)-N-(3-chlorophenyl)-2-(4-chlorophenyl)-2-formamidoacetamide (CID 685016) is (2S)-N-(3-chlorophenyl)-2-(4-chlorophenyl)-2-formamidoacetamide.
What is the SMILES notation for (2S)-N-(3-chlorophenyl)-2-(4-chlorophenyl)-2-formamidoacetamide?
The canonical SMILES for (2S)-N-(3-chlorophenyl)-2-(4-chlorophenyl)-2-formamidoacetamide is O=CN[C@H](C(=O)Nc1cccc(Cl)c1)c1ccc(Cl)cc1.
What is the InChIKey of (2S)-N-(3-chlorophenyl)-2-(4-chlorophenyl)-2-formamidoacetamide?
The InChIKey is MUDNXFQWXNERGQ-AWEZNQCLSA-N. The full InChI is InChI=1S/C15H12Cl2N2O2/c16-11-6-4-10(5-7-11)14(18-9-20)15(21)19-13-3-1-2-12(17)8-13/h1-9,14H,(H,18,20)(H,19,21)/t14-/m0/s1.
What are the key properties of (2S)-N-(3-chlorophenyl)-2-(4-chlorophenyl)-2-formamidoacetamide?
(2S)-N-(3-chlorophenyl)-2-(4-chlorophenyl)-2-formamidoacetamide has a molecular weight of 323.18 g/mol, XLogP of 3.42, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(3-chlorophenyl)-2-(4-chlorophenyl)-2-formamidoacetamide is sourced from PubChem (CID 685016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).