4-ethoxy-N-phenylquinazolin-2-amine

C16H15N3O — CID 134868632

IUPAC4-ethoxy-N-phenylquinazolin-2-amine
SMILESCCOc1nc(Nc2ccccc2)nc2ccccc12
InChIInChI=1S/C16H15N3O/c1-2-20-15-13-10-6-7-11-14(13)18-16(19-15)17-12-8-4-3-5-9-12/h3-11H,2H2,1H3,(H,17,18,19)
InChIKeyLWZCXZFEVSFKOJ-UHFFFAOYSA-N
MW265.32 g/mol
LogP3.77
Rot. Bonds4

About 4-ethoxy-N-phenylquinazolin-2-amine

4-ethoxy-N-phenylquinazolin-2-amine (PubChem CID 134868632) has the molecular formula C16H15N3O and a molecular weight of 265.32 g/mol. Its IUPAC name is 4-ethoxy-N-phenylquinazolin-2-amine.

Molecular Properties

Compound Name4-ethoxy-N-phenylquinazolin-2-amine
PubChem CID134868632
Molecular FormulaC16H15N3O
Molecular Weight265.32 g/mol
Exact Mass265.12
IUPAC Name4-ethoxy-N-phenylquinazolin-2-amine
SMILESCCOc1nc(Nc2ccccc2)nc2ccccc12
InChIInChI=1S/C16H15N3O/c1-2-20-15-13-10-6-7-11-14(13)18-16(19-15)17-12-8-4-3-5-9-12/h3-11H,2H2,1H3,(H,17,18,19)
InChIKeyLWZCXZFEVSFKOJ-UHFFFAOYSA-N
XLogP3.77
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-N-phenylquinazolin-2-amine?
The IUPAC name of 4-ethoxy-N-phenylquinazolin-2-amine (CID 134868632) is 4-ethoxy-N-phenylquinazolin-2-amine.
What is the SMILES notation for 4-ethoxy-N-phenylquinazolin-2-amine?
The canonical SMILES for 4-ethoxy-N-phenylquinazolin-2-amine is CCOc1nc(Nc2ccccc2)nc2ccccc12.
What is the InChIKey of 4-ethoxy-N-phenylquinazolin-2-amine?
The InChIKey is LWZCXZFEVSFKOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O/c1-2-20-15-13-10-6-7-11-14(13)18-16(19-15)17-12-8-4-3-5-9-12/h3-11H,2H2,1H3,(H,17,18,19).
What are the key properties of 4-ethoxy-N-phenylquinazolin-2-amine?
4-ethoxy-N-phenylquinazolin-2-amine has a molecular weight of 265.32 g/mol, XLogP of 3.77, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-N-phenylquinazolin-2-amine is sourced from PubChem (CID 134868632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).