2,7-dimethylquinazolin-4-amine

C10H11N3 — CID 59095817

IUPAC2,7-dimethylquinazolin-4-amine
SMILESCc1ccc2c(N)nc(C)nc2c1
InChIInChI=1S/C10H11N3/c1-6-3-4-8-9(5-6)12-7(2)13-10(8)11/h3-5H,1-2H3,(H2,11,12,13)
InChIKeyQHHOZTBSTMNHCS-UHFFFAOYSA-N
MW173.22 g/mol
LogP1.83
Rot. Bonds

About 2,7-dimethylquinazolin-4-amine

2,7-dimethylquinazolin-4-amine (PubChem CID 59095817) has the molecular formula C10H11N3 and a molecular weight of 173.22 g/mol. Its IUPAC name is 2,7-dimethylquinazolin-4-amine.

Molecular Properties

Compound Name2,7-dimethylquinazolin-4-amine
PubChem CID59095817
Molecular FormulaC10H11N3
Molecular Weight173.22 g/mol
Exact Mass173.10
IUPAC Name2,7-dimethylquinazolin-4-amine
SMILESCc1ccc2c(N)nc(C)nc2c1
InChIInChI=1S/C10H11N3/c1-6-3-4-8-9(5-6)12-7(2)13-10(8)11/h3-5H,1-2H3,(H2,11,12,13)
InChIKeyQHHOZTBSTMNHCS-UHFFFAOYSA-N
XLogP1.83
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.22
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,7-dimethylquinazolin-4-amine?
The IUPAC name of 2,7-dimethylquinazolin-4-amine (CID 59095817) is 2,7-dimethylquinazolin-4-amine.
What is the SMILES notation for 2,7-dimethylquinazolin-4-amine?
The canonical SMILES for 2,7-dimethylquinazolin-4-amine is Cc1ccc2c(N)nc(C)nc2c1.
What is the InChIKey of 2,7-dimethylquinazolin-4-amine?
The InChIKey is QHHOZTBSTMNHCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3/c1-6-3-4-8-9(5-6)12-7(2)13-10(8)11/h3-5H,1-2H3,(H2,11,12,13).
What are the key properties of 2,7-dimethylquinazolin-4-amine?
2,7-dimethylquinazolin-4-amine has a molecular weight of 173.22 g/mol, XLogP of 1.83, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,7-dimethylquinazolin-4-amine is sourced from PubChem (CID 59095817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).