N-[(4-methoxyphenyl)methyl]-2-(3-methyl-2,4-dioxoquinazolin-1-yl)acetamide

C19H19N3O4 — CID 6502426

IUPACN-[(4-methoxyphenyl)methyl]-2-(3-methyl-2,4-dioxoquinazolin-1-yl)acetamide
SMILESCOc1ccc(CNC(=O)Cn2c(=O)n(C)c(=O)c3ccccc32)cc1
InChIInChI=1S/C19H19N3O4/c1-21-18(24)15-5-3-4-6-16(15)22(19(21)25)12-17(23)20-11-13-7-9-14(26-2)10-8-13/h3-10H,11-12H2,1-2H3,(H,20,23)
InChIKeyZOHMVWNRACWFNS-UHFFFAOYSA-N
MW353.38 g/mol
LogP1.03
Rot. Bonds5

About N-[(4-methoxyphenyl)methyl]-2-(3-methyl-2,4-dioxoquinazolin-1-yl)acetamide

N-[(4-methoxyphenyl)methyl]-2-(3-methyl-2,4-dioxoquinazolin-1-yl)acetamide (PubChem CID 6502426) has the molecular formula C19H19N3O4 and a molecular weight of 353.38 g/mol. Its IUPAC name is N-[(4-methoxyphenyl)methyl]-2-(3-methyl-2,4-dioxoquinazolin-1-yl)acetamide.

Molecular Properties

Compound NameN-[(4-methoxyphenyl)methyl]-2-(3-methyl-2,4-dioxoquinazolin-1-yl)acetamide
PubChem CID6502426
Molecular FormulaC19H19N3O4
Molecular Weight353.38 g/mol
Exact Mass353.14
IUPAC NameN-[(4-methoxyphenyl)methyl]-2-(3-methyl-2,4-dioxoquinazolin-1-yl)acetamide
SMILESCOc1ccc(CNC(=O)Cn2c(=O)n(C)c(=O)c3ccccc32)cc1
InChIInChI=1S/C19H19N3O4/c1-21-18(24)15-5-3-4-6-16(15)22(19(21)25)12-17(23)20-11-13-7-9-14(26-2)10-8-13/h3-10H,11-12H2,1-2H3,(H,20,23)
InChIKeyZOHMVWNRACWFNS-UHFFFAOYSA-N
XLogP1.03
TPSA82.33 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.38
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-benzyl-2-(3-methyl-2,4-dioxoquinazolin-1-yl)acetamide
CID 6502382
N-(4-methoxyphenyl)-2-(3-methyl-2,4-dioxoquinazolin-1-yl)acetamide
CID 6502403
N-[(4-chlorophenyl)methyl]-2-(3-methyl-2,4-dioxoquinazolin-1-yl)acetamide
CID 6502441
2-[3-(4-methoxyphenyl)-2,4-dioxoquinazolin-1-yl]-N-[(4-methylphenyl)methyl]acetamide
CID 22429464
2-[3-(furan-2-ylmethyl)-2,4-dioxoquinazolin-1-yl]-N-[(4-methoxyphenyl)methyl]acetamide
CID 6502140
N-(2,4-dimethoxyphenyl)-2-(3-methyl-2,4-dioxoquinazolin-1-yl)acetamide
CID 6502390
N-[(4-methoxyphenyl)methyl]-2-(4-oxopyrazolo[1,5-a]quinoxalin-5-yl)acetamide
CID 101437615
4-[4-[[[2-(3-methyl-2-oxobenzimidazol-1-yl)acetyl]amino]methyl]phenoxy]butanoic acid
CID 119247012
2-indol-1-yl-N-[(4-methoxyphenyl)methyl]acetamide
CID 4224442
2-[3-(4-methoxyphenyl)-2,4-dioxoquinazolin-1-yl]-N-propan-2-ylacetamide
CID 42810869
2-[2,4-dioxo-3-(3,4,5-trimethoxyphenyl)quinazolin-1-yl]-N-[(4-methylphenyl)methyl]acetamide
CID 6621475
2-[3-[2-(3,4-dimethoxyphenyl)ethyl]-2,4-dioxoquinazolin-1-yl]-N-(4-methoxyphenyl)acetamide
CID 22429988

Frequently Asked Questions

What is the IUPAC name of N-[(4-methoxyphenyl)methyl]-2-(3-methyl-2,4-dioxoquinazolin-1-yl)acetamide?
The IUPAC name of N-[(4-methoxyphenyl)methyl]-2-(3-methyl-2,4-dioxoquinazolin-1-yl)acetamide (CID 6502426) is N-[(4-methoxyphenyl)methyl]-2-(3-methyl-2,4-dioxoquinazolin-1-yl)acetamide.
What is the SMILES notation for N-[(4-methoxyphenyl)methyl]-2-(3-methyl-2,4-dioxoquinazolin-1-yl)acetamide?
The canonical SMILES for N-[(4-methoxyphenyl)methyl]-2-(3-methyl-2,4-dioxoquinazolin-1-yl)acetamide is COc1ccc(CNC(=O)Cn2c(=O)n(C)c(=O)c3ccccc32)cc1.
What is the InChIKey of N-[(4-methoxyphenyl)methyl]-2-(3-methyl-2,4-dioxoquinazolin-1-yl)acetamide?
The InChIKey is ZOHMVWNRACWFNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O4/c1-21-18(24)15-5-3-4-6-16(15)22(19(21)25)12-17(23)20-11-13-7-9-14(26-2)10-8-13/h3-10H,11-12H2,1-2H3,(H,20,23).
What are the key properties of N-[(4-methoxyphenyl)methyl]-2-(3-methyl-2,4-dioxoquinazolin-1-yl)acetamide?
N-[(4-methoxyphenyl)methyl]-2-(3-methyl-2,4-dioxoquinazolin-1-yl)acetamide has a molecular weight of 353.38 g/mol, XLogP of 1.03, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methoxyphenyl)methyl]-2-(3-methyl-2,4-dioxoquinazolin-1-yl)acetamide is sourced from PubChem (CID 6502426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).