4,6,7-trimethylquinazolin-2-amine

C11H13N3 — CID 919132

IUPAC4,6,7-trimethylquinazolin-2-amine
SMILESCc1cc2nc(N)nc(C)c2cc1C
InChIInChI=1S/C11H13N3/c1-6-4-9-8(3)13-11(12)14-10(9)5-7(6)2/h4-5H,1-3H3,(H2,12,13,14)
InChIKeyJHVVHFUCCXBAKY-UHFFFAOYSA-N
MW187.25 g/mol
LogP2.14
Rot. Bonds

About 4,6,7-trimethylquinazolin-2-amine

4,6,7-trimethylquinazolin-2-amine (PubChem CID 919132) has the molecular formula C11H13N3 and a molecular weight of 187.25 g/mol. Its IUPAC name is 4,6,7-trimethylquinazolin-2-amine.

Molecular Properties

Compound Name4,6,7-trimethylquinazolin-2-amine
PubChem CID919132
Molecular FormulaC11H13N3
Molecular Weight187.25 g/mol
Exact Mass187.11
IUPAC Name4,6,7-trimethylquinazolin-2-amine
SMILESCc1cc2nc(N)nc(C)c2cc1C
InChIInChI=1S/C11H13N3/c1-6-4-9-8(3)13-11(12)14-10(9)5-7(6)2/h4-5H,1-3H3,(H2,12,13,14)
InChIKeyJHVVHFUCCXBAKY-UHFFFAOYSA-N
XLogP2.14
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.25
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4,6,7-trimethylquinazolin-2-amine?
The IUPAC name of 4,6,7-trimethylquinazolin-2-amine (CID 919132) is 4,6,7-trimethylquinazolin-2-amine.
What is the SMILES notation for 4,6,7-trimethylquinazolin-2-amine?
The canonical SMILES for 4,6,7-trimethylquinazolin-2-amine is Cc1cc2nc(N)nc(C)c2cc1C.
What is the InChIKey of 4,6,7-trimethylquinazolin-2-amine?
The InChIKey is JHVVHFUCCXBAKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3/c1-6-4-9-8(3)13-11(12)14-10(9)5-7(6)2/h4-5H,1-3H3,(H2,12,13,14).
What are the key properties of 4,6,7-trimethylquinazolin-2-amine?
4,6,7-trimethylquinazolin-2-amine has a molecular weight of 187.25 g/mol, XLogP of 2.14, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6,7-trimethylquinazolin-2-amine is sourced from PubChem (CID 919132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).