3,8-dimethyl-2H-quinazoline

C10H12N2 — CID 152633432

IUPAC3,8-dimethyl-2H-quinazoline
SMILESCc1cccc2c1=NCN(C)C=2
InChIInChI=1S/C10H12N2/c1-8-4-3-5-9-6-12(2)7-11-10(8)9/h3-6H,7H2,1-2H3
InChIKeyZEABFKITGPZSSF-UHFFFAOYSA-N
MW160.22 g/mol
LogP0.26
Rot. Bonds

About 3,8-dimethyl-2H-quinazoline

3,8-dimethyl-2H-quinazoline (PubChem CID 152633432) has the molecular formula C10H12N2 and a molecular weight of 160.22 g/mol. Its IUPAC name is 3,8-dimethyl-2H-quinazoline.

Molecular Properties

Compound Name3,8-dimethyl-2H-quinazoline
PubChem CID152633432
Molecular FormulaC10H12N2
Molecular Weight160.22 g/mol
Exact Mass160.10
IUPAC Name3,8-dimethyl-2H-quinazoline
SMILESCc1cccc2c1=NCN(C)C=2
InChIInChI=1S/C10H12N2/c1-8-4-3-5-9-6-12(2)7-11-10(8)9/h3-6H,7H2,1-2H3
InChIKeyZEABFKITGPZSSF-UHFFFAOYSA-N
XLogP0.26
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.22
LogP ≤ 50.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-Methylquinazolinone
CID 70515486
Quinazoline, 2,3-dihydro-2-imino-3-methyl-
CID 171383925
Pyrido[2,1-b]quinazoline
CID 16637595
3-Bromoquinazoline
CID 21897181
Quinazoline-3-ol
CID 23192565
Azepino[2,1-b]quinazoline
CID 54195578
3-Methylquinazoline
CID 68345740
Pyrazino[2,1-b]quinazoline
CID 129653308
2-fluoro-3-methyl-2H-quinazoline
CID 150705953
2-fluoro-3,6-dimethyl-2H-quinazoline
CID 151270095
3-fluoro-2H-quinazoline
CID 176107688
3-Ethylquinazoline-2-thiol
CID 129756497

Frequently Asked Questions

What is the IUPAC name of 3,8-dimethyl-2H-quinazoline?
The IUPAC name of 3,8-dimethyl-2H-quinazoline (CID 152633432) is 3,8-dimethyl-2H-quinazoline.
What is the SMILES notation for 3,8-dimethyl-2H-quinazoline?
The canonical SMILES for 3,8-dimethyl-2H-quinazoline is Cc1cccc2c1=NCN(C)C=2.
What is the InChIKey of 3,8-dimethyl-2H-quinazoline?
The InChIKey is ZEABFKITGPZSSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2/c1-8-4-3-5-9-6-12(2)7-11-10(8)9/h3-6H,7H2,1-2H3.
What are the key properties of 3,8-dimethyl-2H-quinazoline?
3,8-dimethyl-2H-quinazoline has a molecular weight of 160.22 g/mol, XLogP of 0.26, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,8-dimethyl-2H-quinazoline is sourced from PubChem (CID 152633432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).