N-ethyl-2-[4-(4-methoxyphenyl)-6-oxopyrimidin-1-yl]-N-(3-methylphenyl)acetamide

C22H23N3O3 — CID 121063850

IUPACN-ethyl-2-[4-(4-methoxyphenyl)-6-oxopyrimidin-1-yl]-N-(3-methylphenyl)acetamide
SMILESCCN(C(=O)Cn1cnc(-c2ccc(OC)cc2)cc1=O)c1cccc(C)c1
InChIInChI=1S/C22H23N3O3/c1-4-25(18-7-5-6-16(2)12-18)22(27)14-24-15-23-20(13-21(24)26)17-8-10-19(28-3)11-9-17/h5-13,15H,4,14H2,1-3H3
InChIKeyWHRAVIWUAOLYEV-UHFFFAOYSA-N
MW377.44 g/mol
LogP3.28
Rot. Bonds6

About N-ethyl-2-[4-(4-methoxyphenyl)-6-oxopyrimidin-1-yl]-N-(3-methylphenyl)acetamide

N-ethyl-2-[4-(4-methoxyphenyl)-6-oxopyrimidin-1-yl]-N-(3-methylphenyl)acetamide (PubChem CID 121063850) has the molecular formula C22H23N3O3 and a molecular weight of 377.44 g/mol. Its IUPAC name is N-ethyl-2-[4-(4-methoxyphenyl)-6-oxopyrimidin-1-yl]-N-(3-methylphenyl)acetamide.

Molecular Properties

Compound NameN-ethyl-2-[4-(4-methoxyphenyl)-6-oxopyrimidin-1-yl]-N-(3-methylphenyl)acetamide
PubChem CID121063850
Molecular FormulaC22H23N3O3
Molecular Weight377.44 g/mol
Exact Mass377.17
IUPAC NameN-ethyl-2-[4-(4-methoxyphenyl)-6-oxopyrimidin-1-yl]-N-(3-methylphenyl)acetamide
SMILESCCN(C(=O)Cn1cnc(-c2ccc(OC)cc2)cc1=O)c1cccc(C)c1
InChIInChI=1S/C22H23N3O3/c1-4-25(18-7-5-6-16(2)12-18)22(27)14-24-15-23-20(13-21(24)26)17-8-10-19(28-3)11-9-17/h5-13,15H,4,14H2,1-3H3
InChIKeyWHRAVIWUAOLYEV-UHFFFAOYSA-N
XLogP3.28
TPSA64.43 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.44
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-[4-(4-methoxyphenyl)-6-oxopyrimidin-1-yl]ethyl]-2-(3-methylphenoxy)acetamide
CID 90515885
N-[2-[4-(4-methoxyphenyl)-6-oxopyrimidin-1-yl]ethyl]-2-(3-methylphenoxy)propanamide
CID 90515888
N-ethyl-5-(4-methoxyphenyl)-N-(3-methylphenyl)-5-oxopentanamide
CID 110298284
N-ethyl-2-[4-(furan-2-yl)-6-oxopyrimidin-1-yl]-N-phenylacetamide
CID 121090622
3-[2-[4-(3-methoxyphenyl)piperazin-1-yl]-2-oxoethyl]-6-(4-methylphenyl)pyrimidin-4-one
CID 121063732
N,N-diethyl-3-(4-methoxyphenyl)-1-(3-methylphenyl)pyrazole-5-carboxamide
CID 3919541
2-[5-[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]-2-oxo-1-pyridinyl]-N-ethyl-N-(3-methylphenyl)acetamide
CID 51366711
N-ethyl-N-(3-methylphenyl)-3-phenoxypropanamide
CID 113099032
2-[5-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-2-oxo-1-pyridinyl]-N-ethyl-N-(3-methylphenyl)acetamide
CID 53132567
N-ethyl-N-(3-methylphenyl)-2-(4-oxo-5-phenylthieno[2,3-d]pyrimidin-3-yl)acetamide
CID 7732204
N-ethyl-5-[(4-methoxyphenyl)methylamino]-N-(3-methylphenyl)pyridine-2-carboxamide
CID 109190548
2-(3-methoxyphenoxy)-N-[2-[4-(4-methoxyphenyl)-6-oxopyrimidin-1-yl]ethyl]acetamide
CID 90515868

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[4-(4-methoxyphenyl)-6-oxopyrimidin-1-yl]-N-(3-methylphenyl)acetamide?
The IUPAC name of N-ethyl-2-[4-(4-methoxyphenyl)-6-oxopyrimidin-1-yl]-N-(3-methylphenyl)acetamide (CID 121063850) is N-ethyl-2-[4-(4-methoxyphenyl)-6-oxopyrimidin-1-yl]-N-(3-methylphenyl)acetamide.
What is the SMILES notation for N-ethyl-2-[4-(4-methoxyphenyl)-6-oxopyrimidin-1-yl]-N-(3-methylphenyl)acetamide?
The canonical SMILES for N-ethyl-2-[4-(4-methoxyphenyl)-6-oxopyrimidin-1-yl]-N-(3-methylphenyl)acetamide is CCN(C(=O)Cn1cnc(-c2ccc(OC)cc2)cc1=O)c1cccc(C)c1.
What is the InChIKey of N-ethyl-2-[4-(4-methoxyphenyl)-6-oxopyrimidin-1-yl]-N-(3-methylphenyl)acetamide?
The InChIKey is WHRAVIWUAOLYEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O3/c1-4-25(18-7-5-6-16(2)12-18)22(27)14-24-15-23-20(13-21(24)26)17-8-10-19(28-3)11-9-17/h5-13,15H,4,14H2,1-3H3.
What are the key properties of N-ethyl-2-[4-(4-methoxyphenyl)-6-oxopyrimidin-1-yl]-N-(3-methylphenyl)acetamide?
N-ethyl-2-[4-(4-methoxyphenyl)-6-oxopyrimidin-1-yl]-N-(3-methylphenyl)acetamide has a molecular weight of 377.44 g/mol, XLogP of 3.28, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[4-(4-methoxyphenyl)-6-oxopyrimidin-1-yl]-N-(3-methylphenyl)acetamide is sourced from PubChem (CID 121063850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).