ethyl N-(3-quinazolin-4-yloxyphenyl)carbamate

C17H15N3O3 — CID 31538412

IUPACethyl N-(3-quinazolin-4-yloxyphenyl)carbamate
SMILESCCOC(=O)Nc1cccc(Oc2ncnc3ccccc23)c1
InChIInChI=1S/C17H15N3O3/c1-2-22-17(21)20-12-6-5-7-13(10-12)23-16-14-8-3-4-9-15(14)18-11-19-16/h3-11H,2H2,1H3,(H,20,21)
InChIKeyZTZYISRRNVMYOA-UHFFFAOYSA-N
MW309.33 g/mol
LogP3.99
Rot. Bonds4

About ethyl N-(3-quinazolin-4-yloxyphenyl)carbamate

ethyl N-(3-quinazolin-4-yloxyphenyl)carbamate (PubChem CID 31538412) has the molecular formula C17H15N3O3 and a molecular weight of 309.33 g/mol. Its IUPAC name is ethyl N-(3-quinazolin-4-yloxyphenyl)carbamate.

Molecular Properties

Compound Nameethyl N-(3-quinazolin-4-yloxyphenyl)carbamate
PubChem CID31538412
Molecular FormulaC17H15N3O3
Molecular Weight309.33 g/mol
Exact Mass309.11
IUPAC Nameethyl N-(3-quinazolin-4-yloxyphenyl)carbamate
SMILESCCOC(=O)Nc1cccc(Oc2ncnc3ccccc23)c1
InChIInChI=1S/C17H15N3O3/c1-2-22-17(21)20-12-6-5-7-13(10-12)23-16-14-8-3-4-9-15(14)18-11-19-16/h3-11H,2H2,1H3,(H,20,21)
InChIKeyZTZYISRRNVMYOA-UHFFFAOYSA-N
XLogP3.99
TPSA73.34 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.33
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl N-(2-quinazolin-4-yloxyacetyl)carbamate
CID 2630697
ethyl N-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate
CID 54582388
ethyl N-[3-(ethoxycarbonylamino)phenyl]carbamate
CID 897252
ethyl N-(3-propoxyphenyl)carbamate
CID 60643143
2-(3-quinazolin-4-yloxyphenyl)acetic acid
CID 61398015
2-methyl-4-quinazolin-4-yloxyaniline
CID 60895454
3-methyl-N-(4-quinazolin-4-yloxyphenyl)benzamide
CID 24661832
ethyl N-[3-(2-methylpropoxy)phenyl]carbamate
CID 60643144
ethyl N-[3-(difluoromethoxy)phenyl]carbamate
CID 61062462
N-(3,5-dimethoxyphenyl)-2-quinazolin-4-yloxyacetamide
CID 2375476
[3-(ethoxycarbonylamino)phenyl]carbamic acid
CID 12763081
N-(4-bromo-3-methylphenyl)-2-quinazolin-4-yloxyacetamide
CID 2706655

Frequently Asked Questions

What is the IUPAC name of ethyl N-(3-quinazolin-4-yloxyphenyl)carbamate?
The IUPAC name of ethyl N-(3-quinazolin-4-yloxyphenyl)carbamate (CID 31538412) is ethyl N-(3-quinazolin-4-yloxyphenyl)carbamate.
What is the SMILES notation for ethyl N-(3-quinazolin-4-yloxyphenyl)carbamate?
The canonical SMILES for ethyl N-(3-quinazolin-4-yloxyphenyl)carbamate is CCOC(=O)Nc1cccc(Oc2ncnc3ccccc23)c1.
What is the InChIKey of ethyl N-(3-quinazolin-4-yloxyphenyl)carbamate?
The InChIKey is ZTZYISRRNVMYOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O3/c1-2-22-17(21)20-12-6-5-7-13(10-12)23-16-14-8-3-4-9-15(14)18-11-19-16/h3-11H,2H2,1H3,(H,20,21).
What are the key properties of ethyl N-(3-quinazolin-4-yloxyphenyl)carbamate?
ethyl N-(3-quinazolin-4-yloxyphenyl)carbamate has a molecular weight of 309.33 g/mol, XLogP of 3.99, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-(3-quinazolin-4-yloxyphenyl)carbamate is sourced from PubChem (CID 31538412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).