N-[1-ethyl-2-(4-methoxyphenyl)-6-oxopyrimidin-5-yl]benzamide

C20H19N3O3 — CID 142150656

IUPACN-[1-ethyl-2-(4-methoxyphenyl)-6-oxopyrimidin-5-yl]benzamide
SMILESCCn1c(-c2ccc(OC)cc2)ncc(NC(=O)c2ccccc2)c1=O
InChIInChI=1S/C20H19N3O3/c1-3-23-18(14-9-11-16(26-2)12-10-14)21-13-17(20(23)25)22-19(24)15-7-5-4-6-8-15/h4-13H,3H2,1-2H3,(H,22,24)
InChIKeyVTILPQRLNIRDHT-UHFFFAOYSA-N
MW349.39 g/mol
LogP3.19
Rot. Bonds5

About N-[1-ethyl-2-(4-methoxyphenyl)-6-oxopyrimidin-5-yl]benzamide

N-[1-ethyl-2-(4-methoxyphenyl)-6-oxopyrimidin-5-yl]benzamide (PubChem CID 142150656) has the molecular formula C20H19N3O3 and a molecular weight of 349.39 g/mol. Its IUPAC name is N-[1-ethyl-2-(4-methoxyphenyl)-6-oxopyrimidin-5-yl]benzamide.

Molecular Properties

Compound NameN-[1-ethyl-2-(4-methoxyphenyl)-6-oxopyrimidin-5-yl]benzamide
PubChem CID142150656
Molecular FormulaC20H19N3O3
Molecular Weight349.39 g/mol
Exact Mass349.14
IUPAC NameN-[1-ethyl-2-(4-methoxyphenyl)-6-oxopyrimidin-5-yl]benzamide
SMILESCCn1c(-c2ccc(OC)cc2)ncc(NC(=O)c2ccccc2)c1=O
InChIInChI=1S/C20H19N3O3/c1-3-23-18(14-9-11-16(26-2)12-10-14)21-13-17(20(23)25)22-19(24)15-7-5-4-6-8-15/h4-13H,3H2,1-2H3,(H,22,24)
InChIKeyVTILPQRLNIRDHT-UHFFFAOYSA-N
XLogP3.19
TPSA73.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.39
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[1-ethyl-2-(4-methoxyphenyl)-6-oxopyrimidin-5-yl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[5-benzamido-2-(4-methoxyphenyl)-6-oxopyrimidin-1-yl]acetic acid
CID 10293083
ethyl 5-benzamido-1-[(4-methoxyphenyl)methyl]-6-oxopyrimidine-2-carboxylate
CID 102333626
2-[5-benzamido-2-(4-chlorophenyl)-6-oxopyrimidin-1-yl]acetic acid
CID 10199998
2-[5-[[3-fluoro-4-(3-methoxyphenyl)benzoyl]amino]-6-oxo-2-phenylpyrimidin-1-yl]acetic acid
CID 175993533
N-[4-(4-methoxyphenyl)-6-(4-methylphenyl)pyrimidin-2-yl]benzamide
CID 20896233
N-[5-(4-methoxyphenyl)-1-methylimidazol-2-yl]benzamide
CID 1096852
3-[(4-methoxybenzoyl)amino]-4-oxopyrido[1,2-a]pyrimidine-7-carboxylic acid
CID 44783251
2-[5-benzamido-2-(3-bromophenyl)-6-oxopyrimidin-1-yl]acetic acid
CID 10159611
N-(6-methoxy-1-methyl-2-oxoquinolin-3-yl)benzamide
CID 101228890
4-methoxy-N-(5-oxo-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-yl)benzamide
CID 18891531
N-[4-(4-chlorophenyl)-6-(4-methoxyphenyl)pyrimidin-2-yl]benzamide
CID 20896243
N-[8-(4-methoxyphenyl)-9-methylpurin-6-yl]benzamide
CID 172597021

Frequently Asked Questions

What is the IUPAC name of N-[1-ethyl-2-(4-methoxyphenyl)-6-oxopyrimidin-5-yl]benzamide?
The IUPAC name of N-[1-ethyl-2-(4-methoxyphenyl)-6-oxopyrimidin-5-yl]benzamide (CID 142150656) is N-[1-ethyl-2-(4-methoxyphenyl)-6-oxopyrimidin-5-yl]benzamide.
What is the SMILES notation for N-[1-ethyl-2-(4-methoxyphenyl)-6-oxopyrimidin-5-yl]benzamide?
The canonical SMILES for N-[1-ethyl-2-(4-methoxyphenyl)-6-oxopyrimidin-5-yl]benzamide is CCn1c(-c2ccc(OC)cc2)ncc(NC(=O)c2ccccc2)c1=O.
What is the InChIKey of N-[1-ethyl-2-(4-methoxyphenyl)-6-oxopyrimidin-5-yl]benzamide?
The InChIKey is VTILPQRLNIRDHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O3/c1-3-23-18(14-9-11-16(26-2)12-10-14)21-13-17(20(23)25)22-19(24)15-7-5-4-6-8-15/h4-13H,3H2,1-2H3,(H,22,24).
What are the key properties of N-[1-ethyl-2-(4-methoxyphenyl)-6-oxopyrimidin-5-yl]benzamide?
N-[1-ethyl-2-(4-methoxyphenyl)-6-oxopyrimidin-5-yl]benzamide has a molecular weight of 349.39 g/mol, XLogP of 3.19, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-ethyl-2-(4-methoxyphenyl)-6-oxopyrimidin-5-yl]benzamide is sourced from PubChem (CID 142150656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).