4-[methyl-(2-methylquinazolin-4-yl)amino]phenol

C16H15N3O — CID 11471089

IUPAC4-[methyl-(2-methylquinazolin-4-yl)amino]phenol
SMILESCc1nc(N(C)c2ccc(O)cc2)c2ccccc2n1
InChIInChI=1S/C16H15N3O/c1-11-17-15-6-4-3-5-14(15)16(18-11)19(2)12-7-9-13(20)10-8-12/h3-10,20H,1-2H3
InChIKeySYAAUQJWTDEQLK-UHFFFAOYSA-N
MW265.32 g/mol
LogP3.41
Rot. Bonds2

About 4-[methyl-(2-methylquinazolin-4-yl)amino]phenol

4-[methyl-(2-methylquinazolin-4-yl)amino]phenol (PubChem CID 11471089) has the molecular formula C16H15N3O and a molecular weight of 265.32 g/mol. Its IUPAC name is 4-[methyl-(2-methylquinazolin-4-yl)amino]phenol.

Molecular Properties

Compound Name4-[methyl-(2-methylquinazolin-4-yl)amino]phenol
PubChem CID11471089
Molecular FormulaC16H15N3O
Molecular Weight265.32 g/mol
Exact Mass265.12
IUPAC Name4-[methyl-(2-methylquinazolin-4-yl)amino]phenol
SMILESCc1nc(N(C)c2ccc(O)cc2)c2ccccc2n1
InChIInChI=1S/C16H15N3O/c1-11-17-15-6-4-3-5-14(15)16(18-11)19(2)12-7-9-13(20)10-8-12/h3-10,20H,1-2H3
InChIKeySYAAUQJWTDEQLK-UHFFFAOYSA-N
XLogP3.41
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[methyl-(2-methylquinazolin-4-yl)amino]phenol?
The IUPAC name of 4-[methyl-(2-methylquinazolin-4-yl)amino]phenol (CID 11471089) is 4-[methyl-(2-methylquinazolin-4-yl)amino]phenol.
What is the SMILES notation for 4-[methyl-(2-methylquinazolin-4-yl)amino]phenol?
The canonical SMILES for 4-[methyl-(2-methylquinazolin-4-yl)amino]phenol is Cc1nc(N(C)c2ccc(O)cc2)c2ccccc2n1.
What is the InChIKey of 4-[methyl-(2-methylquinazolin-4-yl)amino]phenol?
The InChIKey is SYAAUQJWTDEQLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O/c1-11-17-15-6-4-3-5-14(15)16(18-11)19(2)12-7-9-13(20)10-8-12/h3-10,20H,1-2H3.
What are the key properties of 4-[methyl-(2-methylquinazolin-4-yl)amino]phenol?
4-[methyl-(2-methylquinazolin-4-yl)amino]phenol has a molecular weight of 265.32 g/mol, XLogP of 3.41, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[methyl-(2-methylquinazolin-4-yl)amino]phenol is sourced from PubChem (CID 11471089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).