N-(3,5-dimethoxyphenyl)-2-quinazolin-4-yloxyacetamide

C18H17N3O4 — CID 2375476

IUPACN-(3,5-dimethoxyphenyl)-2-quinazolin-4-yloxyacetamide
SMILESCOc1cc(NC(=O)COc2ncnc3ccccc23)cc(OC)c1
InChIInChI=1S/C18H17N3O4/c1-23-13-7-12(8-14(9-13)24-2)21-17(22)10-25-18-15-5-3-4-6-16(15)19-11-20-18/h3-9,11H,10H2,1-2H3,(H,21,22)
InChIKeyXVTPFPFYKRTRFT-UHFFFAOYSA-N
MW339.35 g/mol
LogP2.66
Rot. Bonds6

About N-(3,5-dimethoxyphenyl)-2-quinazolin-4-yloxyacetamide

N-(3,5-dimethoxyphenyl)-2-quinazolin-4-yloxyacetamide (PubChem CID 2375476) has the molecular formula C18H17N3O4 and a molecular weight of 339.35 g/mol. Its IUPAC name is N-(3,5-dimethoxyphenyl)-2-quinazolin-4-yloxyacetamide.

Molecular Properties

Compound NameN-(3,5-dimethoxyphenyl)-2-quinazolin-4-yloxyacetamide
PubChem CID2375476
Molecular FormulaC18H17N3O4
Molecular Weight339.35 g/mol
Exact Mass339.12
IUPAC NameN-(3,5-dimethoxyphenyl)-2-quinazolin-4-yloxyacetamide
SMILESCOc1cc(NC(=O)COc2ncnc3ccccc23)cc(OC)c1
InChIInChI=1S/C18H17N3O4/c1-23-13-7-12(8-14(9-13)24-2)21-17(22)10-25-18-15-5-3-4-6-16(15)19-11-20-18/h3-9,11H,10H2,1-2H3,(H,21,22)
InChIKeyXVTPFPFYKRTRFT-UHFFFAOYSA-N
XLogP2.66
TPSA82.57 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.35
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(4-bromo-3-methylphenyl)-2-quinazolin-4-yloxyacetamide
CID 2706655
N-methyl-2-quinazolin-4-yloxyacetamide
CID 2422162
N-(3,5-dimethoxyphenyl)-2-(1-phenylpyrazolo[5,4-d]pyrimidin-4-yl)oxyacetamide
CID 2122954
methyl 2-[(2-quinazolin-4-yloxyacetyl)amino]benzoate
CID 2393006
[2-(3,5-dimethoxyanilino)-2-oxoethyl] 2-methylquinoline-4-carboxylate
CID 2484664
N-[2-(difluoromethoxy)phenyl]-2-quinazolin-4-yloxyacetamide
CID 2392933
N-(3-methoxyphenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide
CID 2705200
2-quinazolin-4-yloxy-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylacetamide
CID 17415953
N-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)-2-quinazolin-4-yloxyacetamide
CID 4158429
2-(6,8-dichloroquinazolin-4-yl)oxy-N-(3-methoxyphenyl)acetamide
CID 2704087
N-[(1R)-1-phenylethyl]-2-quinazolin-4-yloxyacetamide
CID 2392998
N-(2-phenoxyethyl)-2-quinazolin-4-yloxyacetamide
CID 78801696

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethoxyphenyl)-2-quinazolin-4-yloxyacetamide?
The IUPAC name of N-(3,5-dimethoxyphenyl)-2-quinazolin-4-yloxyacetamide (CID 2375476) is N-(3,5-dimethoxyphenyl)-2-quinazolin-4-yloxyacetamide.
What is the SMILES notation for N-(3,5-dimethoxyphenyl)-2-quinazolin-4-yloxyacetamide?
The canonical SMILES for N-(3,5-dimethoxyphenyl)-2-quinazolin-4-yloxyacetamide is COc1cc(NC(=O)COc2ncnc3ccccc23)cc(OC)c1.
What is the InChIKey of N-(3,5-dimethoxyphenyl)-2-quinazolin-4-yloxyacetamide?
The InChIKey is XVTPFPFYKRTRFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O4/c1-23-13-7-12(8-14(9-13)24-2)21-17(22)10-25-18-15-5-3-4-6-16(15)19-11-20-18/h3-9,11H,10H2,1-2H3,(H,21,22).
What are the key properties of N-(3,5-dimethoxyphenyl)-2-quinazolin-4-yloxyacetamide?
N-(3,5-dimethoxyphenyl)-2-quinazolin-4-yloxyacetamide has a molecular weight of 339.35 g/mol, XLogP of 2.66, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethoxyphenyl)-2-quinazolin-4-yloxyacetamide is sourced from PubChem (CID 2375476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).