2-[2-(4-chlorophenyl)-4-methyl-6-oxopyrimidin-1-yl]-N-(2-methylphenyl)acetamide

C20H18ClN3O2 — CID 91887513

IUPAC2-[2-(4-chlorophenyl)-4-methyl-6-oxopyrimidin-1-yl]-N-(2-methylphenyl)acetamide
SMILESCc1cc(=O)n(CC(=O)Nc2ccccc2C)c(-c2ccc(Cl)cc2)n1
InChIInChI=1S/C20H18ClN3O2/c1-13-5-3-4-6-17(13)23-18(25)12-24-19(26)11-14(2)22-20(24)15-7-9-16(21)10-8-15/h3-11H,12H2,1-2H3,(H,23,25)
InChIKeyMPYSVZAFKGYWKA-UHFFFAOYSA-N
MW367.84 g/mol
LogP3.82
Rot. Bonds4

About 2-[2-(4-chlorophenyl)-4-methyl-6-oxopyrimidin-1-yl]-N-(2-methylphenyl)acetamide

2-[2-(4-chlorophenyl)-4-methyl-6-oxopyrimidin-1-yl]-N-(2-methylphenyl)acetamide (PubChem CID 91887513) has the molecular formula C20H18ClN3O2 and a molecular weight of 367.84 g/mol. Its IUPAC name is 2-[2-(4-chlorophenyl)-4-methyl-6-oxopyrimidin-1-yl]-N-(2-methylphenyl)acetamide.

Molecular Properties

Compound Name2-[2-(4-chlorophenyl)-4-methyl-6-oxopyrimidin-1-yl]-N-(2-methylphenyl)acetamide
PubChem CID91887513
Molecular FormulaC20H18ClN3O2
Molecular Weight367.84 g/mol
Exact Mass367.11
IUPAC Name2-[2-(4-chlorophenyl)-4-methyl-6-oxopyrimidin-1-yl]-N-(2-methylphenyl)acetamide
SMILESCc1cc(=O)n(CC(=O)Nc2ccccc2C)c(-c2ccc(Cl)cc2)n1
InChIInChI=1S/C20H18ClN3O2/c1-13-5-3-4-6-17(13)23-18(25)12-24-19(26)11-14(2)22-20(24)15-7-9-16(21)10-8-15/h3-11H,12H2,1-2H3,(H,23,25)
InChIKeyMPYSVZAFKGYWKA-UHFFFAOYSA-N
XLogP3.82
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.84
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

L 735821
CID 5282279
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N-[(4-chlorophenyl)methyl]-2-(2-oxo-4-phenylquinazolin-1-yl)acetamide
CID 8721714
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CID 15998487
3-{[2-(4-Chlorophenyl)ethyl]amino}-1-phenyl-1,2-dihydropyrazin-2-one
CID 16025725
7-chloro-1-[(4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]-5-phenyl-3H-1,4-benzodiazepin-2-one
CID 20854354
1-benzyl-N-[2-(5-chloro-2-methylanilino)-2-oxoethyl]-N-ethyl-6-oxopyridazine-3-carboxamide
CID 24686915
N-(3-chloro-2-methylphenyl)-2-[3-(4-fluorophenyl)-5-oxo-1,2,4-oxadiazol-4-yl]acetamide
CID 1434973
N-(5-chloro-2-methylphenyl)-2-(4-methyl-6-oxo-2-propan-2-ylpyrimidin-1-yl)acetamide
CID 2425814
Slupp-225
CID 137636055
(E)-3-(4-chlorophenyl)-N-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]prop-2-enamide
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Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-chlorophenyl)-4-methyl-6-oxopyrimidin-1-yl]-N-(2-methylphenyl)acetamide?
The IUPAC name of 2-[2-(4-chlorophenyl)-4-methyl-6-oxopyrimidin-1-yl]-N-(2-methylphenyl)acetamide (CID 91887513) is 2-[2-(4-chlorophenyl)-4-methyl-6-oxopyrimidin-1-yl]-N-(2-methylphenyl)acetamide.
What is the SMILES notation for 2-[2-(4-chlorophenyl)-4-methyl-6-oxopyrimidin-1-yl]-N-(2-methylphenyl)acetamide?
The canonical SMILES for 2-[2-(4-chlorophenyl)-4-methyl-6-oxopyrimidin-1-yl]-N-(2-methylphenyl)acetamide is Cc1cc(=O)n(CC(=O)Nc2ccccc2C)c(-c2ccc(Cl)cc2)n1.
What is the InChIKey of 2-[2-(4-chlorophenyl)-4-methyl-6-oxopyrimidin-1-yl]-N-(2-methylphenyl)acetamide?
The InChIKey is MPYSVZAFKGYWKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18ClN3O2/c1-13-5-3-4-6-17(13)23-18(25)12-24-19(26)11-14(2)22-20(24)15-7-9-16(21)10-8-15/h3-11H,12H2,1-2H3,(H,23,25).
What are the key properties of 2-[2-(4-chlorophenyl)-4-methyl-6-oxopyrimidin-1-yl]-N-(2-methylphenyl)acetamide?
2-[2-(4-chlorophenyl)-4-methyl-6-oxopyrimidin-1-yl]-N-(2-methylphenyl)acetamide has a molecular weight of 367.84 g/mol, XLogP of 3.82, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-chlorophenyl)-4-methyl-6-oxopyrimidin-1-yl]-N-(2-methylphenyl)acetamide is sourced from PubChem (CID 91887513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).