N-[2-(3-methyl-4-oxoquinazolin-2-yl)ethyl]-2-phenoxyacetamide

C19H19N3O3 — CID 110712288

IUPACN-[2-(3-methyl-4-oxoquinazolin-2-yl)ethyl]-2-phenoxyacetamide
SMILESCn1c(CCNC(=O)COc2ccccc2)nc2ccccc2c1=O
InChIInChI=1S/C19H19N3O3/c1-22-17(21-16-10-6-5-9-15(16)19(22)24)11-12-20-18(23)13-25-14-7-3-2-4-8-14/h2-10H,11-13H2,1H3,(H,20,23)
InChIKeyWLZGBUAKEYUFHB-UHFFFAOYSA-N
MW337.38 g/mol
LogP1.67
Rot. Bonds6

About N-[2-(3-methyl-4-oxoquinazolin-2-yl)ethyl]-2-phenoxyacetamide

N-[2-(3-methyl-4-oxoquinazolin-2-yl)ethyl]-2-phenoxyacetamide (PubChem CID 110712288) has the molecular formula C19H19N3O3 and a molecular weight of 337.38 g/mol. Its IUPAC name is N-[2-(3-methyl-4-oxoquinazolin-2-yl)ethyl]-2-phenoxyacetamide.

Molecular Properties

Compound NameN-[2-(3-methyl-4-oxoquinazolin-2-yl)ethyl]-2-phenoxyacetamide
PubChem CID110712288
Molecular FormulaC19H19N3O3
Molecular Weight337.38 g/mol
Exact Mass337.14
IUPAC NameN-[2-(3-methyl-4-oxoquinazolin-2-yl)ethyl]-2-phenoxyacetamide
SMILESCn1c(CCNC(=O)COc2ccccc2)nc2ccccc2c1=O
InChIInChI=1S/C19H19N3O3/c1-22-17(21-16-10-6-5-9-15(16)19(22)24)11-12-20-18(23)13-25-14-7-3-2-4-8-14/h2-10H,11-13H2,1H3,(H,20,23)
InChIKeyWLZGBUAKEYUFHB-UHFFFAOYSA-N
XLogP1.67
TPSA73.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3,3-dimethyl-N-[2-(3-methyl-4-oxoquinazolin-2-yl)ethyl]butanamide
CID 110712301
N-[2-(4-methoxyphenoxy)ethyl]-3-(3-methyl-4-oxoquinazolin-2-yl)propanamide
CID 8935859
3-methoxy-N-[2-(3-methyl-4-oxoquinazolin-2-yl)ethyl]benzamide
CID 110712281
2-(4-chlorophenoxy)-N-[2-(1-methylbenzimidazol-2-yl)ethyl]acetamide
CID 16978760
2-(3-fluorophenyl)-N-[2-(3-methyl-4-oxoquinazolin-2-yl)ethyl]acetamide
CID 110712309
N-[2-(1-methylbenzimidazol-2-yl)ethyl]-3-phenoxypropanamide
CID 110711950
N-[2-(4-fluorophenyl)ethyl]-3-(3-methyl-4-oxoquinazolin-2-yl)propanamide
CID 9080818
N-[2-(3-methyl-4-oxoquinazolin-2-yl)ethyl]-6-oxo-1H-pyridazine-3-carboxamide
CID 110741916
[2-(3-methylbutylamino)-2-oxoethyl] 3-(3-methyl-4-oxoquinazolin-2-yl)propanoate
CID 30933282
2-phenoxy-N-[2-[1-(3-phenoxypropyl)benzimidazol-2-yl]ethyl]acetamide
CID 16978511
N-[2-(1-hexylbenzimidazol-2-yl)ethyl]-2-phenoxyacetamide
CID 16978455
methyl 2-[2-[2-[(2-phenoxyacetyl)amino]ethyl]benzimidazol-1-yl]acetate
CID 16978586

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-methyl-4-oxoquinazolin-2-yl)ethyl]-2-phenoxyacetamide?
The IUPAC name of N-[2-(3-methyl-4-oxoquinazolin-2-yl)ethyl]-2-phenoxyacetamide (CID 110712288) is N-[2-(3-methyl-4-oxoquinazolin-2-yl)ethyl]-2-phenoxyacetamide.
What is the SMILES notation for N-[2-(3-methyl-4-oxoquinazolin-2-yl)ethyl]-2-phenoxyacetamide?
The canonical SMILES for N-[2-(3-methyl-4-oxoquinazolin-2-yl)ethyl]-2-phenoxyacetamide is Cn1c(CCNC(=O)COc2ccccc2)nc2ccccc2c1=O.
What is the InChIKey of N-[2-(3-methyl-4-oxoquinazolin-2-yl)ethyl]-2-phenoxyacetamide?
The InChIKey is WLZGBUAKEYUFHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O3/c1-22-17(21-16-10-6-5-9-15(16)19(22)24)11-12-20-18(23)13-25-14-7-3-2-4-8-14/h2-10H,11-13H2,1H3,(H,20,23).
What are the key properties of N-[2-(3-methyl-4-oxoquinazolin-2-yl)ethyl]-2-phenoxyacetamide?
N-[2-(3-methyl-4-oxoquinazolin-2-yl)ethyl]-2-phenoxyacetamide has a molecular weight of 337.38 g/mol, XLogP of 1.67, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-methyl-4-oxoquinazolin-2-yl)ethyl]-2-phenoxyacetamide is sourced from PubChem (CID 110712288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).