ethyl N-(2-quinazolin-4-yloxyacetyl)carbamate

C13H13N3O4 — CID 2630697

IUPACethyl N-(2-quinazolin-4-yloxyacetyl)carbamate
SMILESCCOC(=O)NC(=O)COc1ncnc2ccccc12
InChIInChI=1S/C13H13N3O4/c1-2-19-13(18)16-11(17)7-20-12-9-5-3-4-6-10(9)14-8-15-12/h3-6,8H,2,7H2,1H3,(H,16,17,18)
InChIKeyUZXBTPQKXJXNAC-UHFFFAOYSA-N
MW275.26 g/mol
LogP1.28
Rot. Bonds4

About ethyl N-(2-quinazolin-4-yloxyacetyl)carbamate

ethyl N-(2-quinazolin-4-yloxyacetyl)carbamate (PubChem CID 2630697) has the molecular formula C13H13N3O4 and a molecular weight of 275.26 g/mol. Its IUPAC name is ethyl N-(2-quinazolin-4-yloxyacetyl)carbamate.

Molecular Properties

Compound Nameethyl N-(2-quinazolin-4-yloxyacetyl)carbamate
PubChem CID2630697
Molecular FormulaC13H13N3O4
Molecular Weight275.26 g/mol
Exact Mass275.09
IUPAC Nameethyl N-(2-quinazolin-4-yloxyacetyl)carbamate
SMILESCCOC(=O)NC(=O)COc1ncnc2ccccc12
InChIInChI=1S/C13H13N3O4/c1-2-19-13(18)16-11(17)7-20-12-9-5-3-4-6-10(9)14-8-15-12/h3-6,8H,2,7H2,1H3,(H,16,17,18)
InChIKeyUZXBTPQKXJXNAC-UHFFFAOYSA-N
XLogP1.28
TPSA90.41 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.26
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-methyl-2-quinazolin-4-yloxyacetamide
CID 2422162
diethyl 3-methyl-5-[(2-quinazolin-4-yloxyacetyl)amino]thiophene-2,4-dicarboxylate
CID 2383327
ethyl 5-acetyl-4-methyl-2-[(2-quinazolin-4-yloxyacetyl)amino]thiophene-3-carboxylate
CID 2086114
N-(prop-2-enylcarbamoyl)-2-quinazolin-4-yloxyacetamide
CID 2630701
N-(4-bromo-3-methylphenyl)-2-quinazolin-4-yloxyacetamide
CID 2706655
ethyl N-(3-quinazolin-4-yloxyphenyl)carbamate
CID 31538412
4-ethoxyquinazoline
CID 589708
N-[(1R)-1-phenylethyl]-2-quinazolin-4-yloxyacetamide
CID 2392998
2-quinazolin-4-yloxy-N-(2,2,2-trifluoroethyl)acetamide
CID 2457069
methyl 2-[(2-quinazolin-4-yloxyacetyl)amino]benzoate
CID 2393006
N-(3,5-dimethoxyphenyl)-2-quinazolin-4-yloxyacetamide
CID 2375476
N-(2-phenoxyethyl)-2-quinazolin-4-yloxyacetamide
CID 78801696

Frequently Asked Questions

What is the IUPAC name of ethyl N-(2-quinazolin-4-yloxyacetyl)carbamate?
The IUPAC name of ethyl N-(2-quinazolin-4-yloxyacetyl)carbamate (CID 2630697) is ethyl N-(2-quinazolin-4-yloxyacetyl)carbamate.
What is the SMILES notation for ethyl N-(2-quinazolin-4-yloxyacetyl)carbamate?
The canonical SMILES for ethyl N-(2-quinazolin-4-yloxyacetyl)carbamate is CCOC(=O)NC(=O)COc1ncnc2ccccc12.
What is the InChIKey of ethyl N-(2-quinazolin-4-yloxyacetyl)carbamate?
The InChIKey is UZXBTPQKXJXNAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3O4/c1-2-19-13(18)16-11(17)7-20-12-9-5-3-4-6-10(9)14-8-15-12/h3-6,8H,2,7H2,1H3,(H,16,17,18).
What are the key properties of ethyl N-(2-quinazolin-4-yloxyacetyl)carbamate?
ethyl N-(2-quinazolin-4-yloxyacetyl)carbamate has a molecular weight of 275.26 g/mol, XLogP of 1.28, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-(2-quinazolin-4-yloxyacetyl)carbamate is sourced from PubChem (CID 2630697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).