N-[4-chloro-2-(2-chlorobenzoyl)phenyl]-N-methyl-2-pyrazin-2-ylacetamide

C20H15Cl2N3O2 — CID 70503262

IUPACN-[4-chloro-2-(2-chlorobenzoyl)phenyl]-N-methyl-2-pyrazin-2-ylacetamide
SMILESCN(C(=O)Cc1cnccn1)c1ccc(Cl)cc1C(=O)c1ccccc1Cl
InChIInChI=1S/C20H15Cl2N3O2/c1-25(19(26)11-14-12-23-8-9-24-14)18-7-6-13(21)10-16(18)20(27)15-4-2-3-5-17(15)22/h2-10,12H,11H2,1H3
InChIKeyRPTUCCBAXSTZAB-UHFFFAOYSA-N
MW400.27 g/mol
LogP4.22
Rot. Bonds5

About N-[4-chloro-2-(2-chlorobenzoyl)phenyl]-N-methyl-2-pyrazin-2-ylacetamide

N-[4-chloro-2-(2-chlorobenzoyl)phenyl]-N-methyl-2-pyrazin-2-ylacetamide (PubChem CID 70503262) has the molecular formula C20H15Cl2N3O2 and a molecular weight of 400.27 g/mol. Its IUPAC name is N-[4-chloro-2-(2-chlorobenzoyl)phenyl]-N-methyl-2-pyrazin-2-ylacetamide.

Molecular Properties

Compound NameN-[4-chloro-2-(2-chlorobenzoyl)phenyl]-N-methyl-2-pyrazin-2-ylacetamide
PubChem CID70503262
Molecular FormulaC20H15Cl2N3O2
Molecular Weight400.27 g/mol
Exact Mass399.05
IUPAC NameN-[4-chloro-2-(2-chlorobenzoyl)phenyl]-N-methyl-2-pyrazin-2-ylacetamide
SMILESCN(C(=O)Cc1cnccn1)c1ccc(Cl)cc1C(=O)c1ccccc1Cl
InChIInChI=1S/C20H15Cl2N3O2/c1-25(19(26)11-14-12-23-8-9-24-14)18-7-6-13(21)10-16(18)20(27)15-4-2-3-5-17(15)22/h2-10,12H,11H2,1H3
InChIKeyRPTUCCBAXSTZAB-UHFFFAOYSA-N
XLogP4.22
TPSA63.16 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.27
LogP ≤ 54.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-chloro-2-(2-chlorobenzoyl)phenyl]-2-(cyclopentylamino)-N-methylacetamide;hydrochloride
CID 3058807
N-[4-chloro-2-(2-chlorobenzoyl)phenyl]-N-methyl-2-(2-methylbut-3-yn-2-ylamino)acetamide
CID 3058805
[2-[4-chloro-2-(2-chlorobenzoyl)-N-methylanilino]-2-oxoethyl] carbamimidothioate
CID 3080496
butanoic acid;N-[2-[4-chloro-2-(2-chlorobenzoyl)-N-methylanilino]-2-oxoethyl]benzamide
CID 21153641
N-[(4-chlorophenyl)-phenylmethyl]-2-pyrazin-2-ylacetamide
CID 119052114
(2-amino-5-chlorophenyl)-(2-chlorophenyl)methanone
CID 18069
2,5-dichloro-N-[2-oxo-2-(1-pyrazin-2-ylpropan-2-ylamino)ethyl]benzamide
CID 91782726
2-[methyl-(2-pyridin-3-ylacetyl)amino]benzoic acid
CID 62689152
(2-chlorophenyl)-(5-chloro-2-sulfanylphenyl)methanone
CID 139700416
(2-amino-5-chlorophenyl)-(2-chlorophenyl)methanone;hydrochloride
CID 23355179
3-amino-N-(2,4-dichlorophenyl)-N-methylpropanamide
CID 28795222
(2,4-dichlorophenyl)-(2-ethylphenyl)methanone
CID 79020257

Frequently Asked Questions

What is the IUPAC name of N-[4-chloro-2-(2-chlorobenzoyl)phenyl]-N-methyl-2-pyrazin-2-ylacetamide?
The IUPAC name of N-[4-chloro-2-(2-chlorobenzoyl)phenyl]-N-methyl-2-pyrazin-2-ylacetamide (CID 70503262) is N-[4-chloro-2-(2-chlorobenzoyl)phenyl]-N-methyl-2-pyrazin-2-ylacetamide.
What is the SMILES notation for N-[4-chloro-2-(2-chlorobenzoyl)phenyl]-N-methyl-2-pyrazin-2-ylacetamide?
The canonical SMILES for N-[4-chloro-2-(2-chlorobenzoyl)phenyl]-N-methyl-2-pyrazin-2-ylacetamide is CN(C(=O)Cc1cnccn1)c1ccc(Cl)cc1C(=O)c1ccccc1Cl.
What is the InChIKey of N-[4-chloro-2-(2-chlorobenzoyl)phenyl]-N-methyl-2-pyrazin-2-ylacetamide?
The InChIKey is RPTUCCBAXSTZAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15Cl2N3O2/c1-25(19(26)11-14-12-23-8-9-24-14)18-7-6-13(21)10-16(18)20(27)15-4-2-3-5-17(15)22/h2-10,12H,11H2,1H3.
What are the key properties of N-[4-chloro-2-(2-chlorobenzoyl)phenyl]-N-methyl-2-pyrazin-2-ylacetamide?
N-[4-chloro-2-(2-chlorobenzoyl)phenyl]-N-methyl-2-pyrazin-2-ylacetamide has a molecular weight of 400.27 g/mol, XLogP of 4.22, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-chloro-2-(2-chlorobenzoyl)phenyl]-N-methyl-2-pyrazin-2-ylacetamide is sourced from PubChem (CID 70503262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).