N-(4-methoxyphenyl)-N-methylquinazolin-4-amine

C16H15N3O — CID 11254113

IUPACN-(4-methoxyphenyl)-N-methylquinazolin-4-amine
SMILESCOc1ccc(N(C)c2ncnc3ccccc23)cc1
InChIInChI=1S/C16H15N3O/c1-19(12-7-9-13(20-2)10-8-12)16-14-5-3-4-6-15(14)17-11-18-16/h3-11H,1-2H3
InChIKeyDSOZHEAZGXTKSL-UHFFFAOYSA-N
MW265.32 g/mol
LogP3.41
Rot. Bonds3

About N-(4-methoxyphenyl)-N-methylquinazolin-4-amine

N-(4-methoxyphenyl)-N-methylquinazolin-4-amine (PubChem CID 11254113) has the molecular formula C16H15N3O and a molecular weight of 265.32 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-N-methylquinazolin-4-amine.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-N-methylquinazolin-4-amine
PubChem CID11254113
Molecular FormulaC16H15N3O
Molecular Weight265.32 g/mol
Exact Mass265.12
IUPAC NameN-(4-methoxyphenyl)-N-methylquinazolin-4-amine
SMILESCOc1ccc(N(C)c2ncnc3ccccc23)cc1
InChIInChI=1S/C16H15N3O/c1-19(12-7-9-13(20-2)10-8-12)16-14-5-3-4-6-15(14)17-11-18-16/h3-11H,1-2H3
InChIKeyDSOZHEAZGXTKSL-UHFFFAOYSA-N
XLogP3.41
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 53.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-N-methylquinazolin-4-amine?
The IUPAC name of N-(4-methoxyphenyl)-N-methylquinazolin-4-amine (CID 11254113) is N-(4-methoxyphenyl)-N-methylquinazolin-4-amine.
What is the SMILES notation for N-(4-methoxyphenyl)-N-methylquinazolin-4-amine?
The canonical SMILES for N-(4-methoxyphenyl)-N-methylquinazolin-4-amine is COc1ccc(N(C)c2ncnc3ccccc23)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-N-methylquinazolin-4-amine?
The InChIKey is DSOZHEAZGXTKSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O/c1-19(12-7-9-13(20-2)10-8-12)16-14-5-3-4-6-15(14)17-11-18-16/h3-11H,1-2H3.
What are the key properties of N-(4-methoxyphenyl)-N-methylquinazolin-4-amine?
N-(4-methoxyphenyl)-N-methylquinazolin-4-amine has a molecular weight of 265.32 g/mol, XLogP of 3.41, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-N-methylquinazolin-4-amine is sourced from PubChem (CID 11254113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).