N-(2,5-dimethoxyphenyl)-2-(2-ethyl-4-oxoquinazolin-3-yl)acetamide

C20H21N3O4 — CID 4984690

IUPACN-(2,5-dimethoxyphenyl)-2-(2-ethyl-4-oxoquinazolin-3-yl)acetamide
SMILESCCc1nc2ccccc2c(=O)n1CC(=O)Nc1cc(OC)ccc1OC
InChIInChI=1S/C20H21N3O4/c1-4-18-21-15-8-6-5-7-14(15)20(25)23(18)12-19(24)22-16-11-13(26-2)9-10-17(16)27-3/h5-11H,4,12H2,1-3H3,(H,22,24)
InChIKeySALANZJGKDORQA-UHFFFAOYSA-N
MW367.41 g/mol
LogP2.61
Rot. Bonds6

About N-(2,5-dimethoxyphenyl)-2-(2-ethyl-4-oxoquinazolin-3-yl)acetamide

N-(2,5-dimethoxyphenyl)-2-(2-ethyl-4-oxoquinazolin-3-yl)acetamide (PubChem CID 4984690) has the molecular formula C20H21N3O4 and a molecular weight of 367.41 g/mol. Its IUPAC name is N-(2,5-dimethoxyphenyl)-2-(2-ethyl-4-oxoquinazolin-3-yl)acetamide.

Molecular Properties

Compound NameN-(2,5-dimethoxyphenyl)-2-(2-ethyl-4-oxoquinazolin-3-yl)acetamide
PubChem CID4984690
Molecular FormulaC20H21N3O4
Molecular Weight367.41 g/mol
Exact Mass367.15
IUPAC NameN-(2,5-dimethoxyphenyl)-2-(2-ethyl-4-oxoquinazolin-3-yl)acetamide
SMILESCCc1nc2ccccc2c(=O)n1CC(=O)Nc1cc(OC)ccc1OC
InChIInChI=1S/C20H21N3O4/c1-4-18-21-15-8-6-5-7-14(15)20(25)23(18)12-19(24)22-16-11-13(26-2)9-10-17(16)27-3/h5-11H,4,12H2,1-3H3,(H,22,24)
InChIKeySALANZJGKDORQA-UHFFFAOYSA-N
XLogP2.61
TPSA82.45 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.41
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethoxyphenyl)-2-(2-ethyl-4-oxoquinazolin-3-yl)acetamide?
The IUPAC name of N-(2,5-dimethoxyphenyl)-2-(2-ethyl-4-oxoquinazolin-3-yl)acetamide (CID 4984690) is N-(2,5-dimethoxyphenyl)-2-(2-ethyl-4-oxoquinazolin-3-yl)acetamide.
What is the SMILES notation for N-(2,5-dimethoxyphenyl)-2-(2-ethyl-4-oxoquinazolin-3-yl)acetamide?
The canonical SMILES for N-(2,5-dimethoxyphenyl)-2-(2-ethyl-4-oxoquinazolin-3-yl)acetamide is CCc1nc2ccccc2c(=O)n1CC(=O)Nc1cc(OC)ccc1OC.
What is the InChIKey of N-(2,5-dimethoxyphenyl)-2-(2-ethyl-4-oxoquinazolin-3-yl)acetamide?
The InChIKey is SALANZJGKDORQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O4/c1-4-18-21-15-8-6-5-7-14(15)20(25)23(18)12-19(24)22-16-11-13(26-2)9-10-17(16)27-3/h5-11H,4,12H2,1-3H3,(H,22,24).
What are the key properties of N-(2,5-dimethoxyphenyl)-2-(2-ethyl-4-oxoquinazolin-3-yl)acetamide?
N-(2,5-dimethoxyphenyl)-2-(2-ethyl-4-oxoquinazolin-3-yl)acetamide has a molecular weight of 367.41 g/mol, XLogP of 2.61, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethoxyphenyl)-2-(2-ethyl-4-oxoquinazolin-3-yl)acetamide is sourced from PubChem (CID 4984690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).