6-methyl-N-(2-methyl-2-methylsulfanylpropyl)quinazolin-4-amine

C14H19N3S — CID 133327399

IUPAC6-methyl-N-(2-methyl-2-methylsulfanylpropyl)quinazolin-4-amine
SMILESCSC(C)(C)CNc1ncnc2ccc(C)cc12
InChIInChI=1S/C14H19N3S/c1-10-5-6-12-11(7-10)13(17-9-16-12)15-8-14(2,3)18-4/h5-7,9H,8H2,1-4H3,(H,15,16,17)
InChIKeyWRICYAZFFGJDJP-UHFFFAOYSA-N
MW261.39 g/mol
LogP3.49
Rot. Bonds4

About 6-methyl-N-(2-methyl-2-methylsulfanylpropyl)quinazolin-4-amine

6-methyl-N-(2-methyl-2-methylsulfanylpropyl)quinazolin-4-amine (PubChem CID 133327399) has the molecular formula C14H19N3S and a molecular weight of 261.39 g/mol. Its IUPAC name is 6-methyl-N-(2-methyl-2-methylsulfanylpropyl)quinazolin-4-amine.

Molecular Properties

Compound Name6-methyl-N-(2-methyl-2-methylsulfanylpropyl)quinazolin-4-amine
PubChem CID133327399
Molecular FormulaC14H19N3S
Molecular Weight261.39 g/mol
Exact Mass261.13
IUPAC Name6-methyl-N-(2-methyl-2-methylsulfanylpropyl)quinazolin-4-amine
SMILESCSC(C)(C)CNc1ncnc2ccc(C)cc12
InChIInChI=1S/C14H19N3S/c1-10-5-6-12-11(7-10)13(17-9-16-12)15-8-14(2,3)18-4/h5-7,9H,8H2,1-4H3,(H,15,16,17)
InChIKeyWRICYAZFFGJDJP-UHFFFAOYSA-N
XLogP3.49
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.39
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-methyl-N-(2-methyl-2-methylsulfanylpropyl)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

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-(2-methyl-2-methylsulfanylpropyl)quinazolin-4-amine?
The IUPAC name of 6-methyl-N-(2-methyl-2-methylsulfanylpropyl)quinazolin-4-amine (CID 133327399) is 6-methyl-N-(2-methyl-2-methylsulfanylpropyl)quinazolin-4-amine.
What is the SMILES notation for 6-methyl-N-(2-methyl-2-methylsulfanylpropyl)quinazolin-4-amine?
The canonical SMILES for 6-methyl-N-(2-methyl-2-methylsulfanylpropyl)quinazolin-4-amine is CSC(C)(C)CNc1ncnc2ccc(C)cc12.
What is the InChIKey of 6-methyl-N-(2-methyl-2-methylsulfanylpropyl)quinazolin-4-amine?
The InChIKey is WRICYAZFFGJDJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3S/c1-10-5-6-12-11(7-10)13(17-9-16-12)15-8-14(2,3)18-4/h5-7,9H,8H2,1-4H3,(H,15,16,17).
What are the key properties of 6-methyl-N-(2-methyl-2-methylsulfanylpropyl)quinazolin-4-amine?
6-methyl-N-(2-methyl-2-methylsulfanylpropyl)quinazolin-4-amine has a molecular weight of 261.39 g/mol, XLogP of 3.49, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-(2-methyl-2-methylsulfanylpropyl)quinazolin-4-amine is sourced from PubChem (CID 133327399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).