2-[(2-aminophenoxy)methyl]quinazolin-4-amine

C15H14N4O — CID 61026770

IUPAC2-[(2-aminophenoxy)methyl]quinazolin-4-amine
SMILESNc1ccccc1OCc1nc(N)c2ccccc2n1
InChIInChI=1S/C15H14N4O/c16-11-6-2-4-8-13(11)20-9-14-18-12-7-3-1-5-10(12)15(17)19-14/h1-8H,9,16H2,(H2,17,18,19)
InChIKeyKTIIDUKGTLICFK-UHFFFAOYSA-N
MW266.30 g/mol
LogP2.37
Rot. Bonds3

About 2-[(2-aminophenoxy)methyl]quinazolin-4-amine

2-[(2-aminophenoxy)methyl]quinazolin-4-amine (PubChem CID 61026770) has the molecular formula C15H14N4O and a molecular weight of 266.30 g/mol. Its IUPAC name is 2-[(2-aminophenoxy)methyl]quinazolin-4-amine.

Molecular Properties

Compound Name2-[(2-aminophenoxy)methyl]quinazolin-4-amine
PubChem CID61026770
Molecular FormulaC15H14N4O
Molecular Weight266.30 g/mol
Exact Mass266.12
IUPAC Name2-[(2-aminophenoxy)methyl]quinazolin-4-amine
SMILESNc1ccccc1OCc1nc(N)c2ccccc2n1
InChIInChI=1S/C15H14N4O/c16-11-6-2-4-8-13(11)20-9-14-18-12-7-3-1-5-10(12)15(17)19-14/h1-8H,9,16H2,(H2,17,18,19)
InChIKeyKTIIDUKGTLICFK-UHFFFAOYSA-N
XLogP2.37
TPSA87.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze 2-[(2-aminophenoxy)methyl]quinazolin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(4-aminoquinazolin-2-yl)methyl 2,6-dimethoxybenzoate
CID 9451142
(4-aminoquinazolin-2-yl)methyl 3-phenoxypropanoate
CID 27914976
(4-aminoquinazolin-2-yl)methyl 3-methylbut-2-enoate
CID 27911356
(4-aminoquinazolin-2-yl)methyl 2-methyl-2-phenylpropanoate
CID 9451851
2-[(2-chlorophenoxy)methyl]thieno[2,3-d]pyrimidin-4-amine
CID 62193520
(4-aminoquinazolin-2-yl)methyl 4-methoxybenzoate
CID 9451944
2-[(2-chloroquinolin-3-yl)methoxy]aniline
CID 61026521
(4-aminoquinazolin-2-yl)methyl 2-(1,4-dioxo-3H-phthalazin-2-yl)acetate
CID 27908304
2-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)methoxy]aniline
CID 82487970
2-(pyridin-4-ylmethoxy)aniline
CID 16788077
(4-aminoquinazolin-2-yl)methyl 3-fluoro-4-methoxybenzoate
CID 17416373
(4-aminoquinazolin-2-yl)methyl 4-bromo-1H-pyrrole-2-carboxylate
CID 17465323

Frequently Asked Questions

What is the IUPAC name of 2-[(2-aminophenoxy)methyl]quinazolin-4-amine?
The IUPAC name of 2-[(2-aminophenoxy)methyl]quinazolin-4-amine (CID 61026770) is 2-[(2-aminophenoxy)methyl]quinazolin-4-amine.
What is the SMILES notation for 2-[(2-aminophenoxy)methyl]quinazolin-4-amine?
The canonical SMILES for 2-[(2-aminophenoxy)methyl]quinazolin-4-amine is Nc1ccccc1OCc1nc(N)c2ccccc2n1.
What is the InChIKey of 2-[(2-aminophenoxy)methyl]quinazolin-4-amine?
The InChIKey is KTIIDUKGTLICFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O/c16-11-6-2-4-8-13(11)20-9-14-18-12-7-3-1-5-10(12)15(17)19-14/h1-8H,9,16H2,(H2,17,18,19).
What are the key properties of 2-[(2-aminophenoxy)methyl]quinazolin-4-amine?
2-[(2-aminophenoxy)methyl]quinazolin-4-amine has a molecular weight of 266.30 g/mol, XLogP of 2.37, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-aminophenoxy)methyl]quinazolin-4-amine is sourced from PubChem (CID 61026770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).