2-(2-aminoethyl)-7-methoxyquinazolin-4-amine

C11H14N4O — CID 105472508

IUPAC2-(2-aminoethyl)-7-methoxyquinazolin-4-amine
SMILESCOc1ccc2c(N)nc(CCN)nc2c1
InChIInChI=1S/C11H14N4O/c1-16-7-2-3-8-9(6-7)14-10(4-5-12)15-11(8)13/h2-3,6H,4-5,12H2,1H3,(H2,13,14,15)
InChIKeyDOSYJWQUHMWSAR-UHFFFAOYSA-N
MW218.26 g/mol
LogP0.72
Rot. Bonds3

About 2-(2-aminoethyl)-7-methoxyquinazolin-4-amine

2-(2-aminoethyl)-7-methoxyquinazolin-4-amine (PubChem CID 105472508) has the molecular formula C11H14N4O and a molecular weight of 218.26 g/mol. Its IUPAC name is 2-(2-aminoethyl)-7-methoxyquinazolin-4-amine.

Molecular Properties

Compound Name2-(2-aminoethyl)-7-methoxyquinazolin-4-amine
PubChem CID105472508
Molecular FormulaC11H14N4O
Molecular Weight218.26 g/mol
Exact Mass218.12
IUPAC Name2-(2-aminoethyl)-7-methoxyquinazolin-4-amine
SMILESCOc1ccc2c(N)nc(CCN)nc2c1
InChIInChI=1S/C11H14N4O/c1-16-7-2-3-8-9(6-7)14-10(4-5-12)15-11(8)13/h2-3,6H,4-5,12H2,1H3,(H2,13,14,15)
InChIKeyDOSYJWQUHMWSAR-UHFFFAOYSA-N
XLogP0.72
TPSA87.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 50.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(2-aminoethyl)-7-methoxyquinazolin-4-amine?
The IUPAC name of 2-(2-aminoethyl)-7-methoxyquinazolin-4-amine (CID 105472508) is 2-(2-aminoethyl)-7-methoxyquinazolin-4-amine.
What is the SMILES notation for 2-(2-aminoethyl)-7-methoxyquinazolin-4-amine?
The canonical SMILES for 2-(2-aminoethyl)-7-methoxyquinazolin-4-amine is COc1ccc2c(N)nc(CCN)nc2c1.
What is the InChIKey of 2-(2-aminoethyl)-7-methoxyquinazolin-4-amine?
The InChIKey is DOSYJWQUHMWSAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O/c1-16-7-2-3-8-9(6-7)14-10(4-5-12)15-11(8)13/h2-3,6H,4-5,12H2,1H3,(H2,13,14,15).
What are the key properties of 2-(2-aminoethyl)-7-methoxyquinazolin-4-amine?
2-(2-aminoethyl)-7-methoxyquinazolin-4-amine has a molecular weight of 218.26 g/mol, XLogP of 0.72, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminoethyl)-7-methoxyquinazolin-4-amine is sourced from PubChem (CID 105472508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).