4,7-dimethyl-6,7-dihydroquinazoline

C10H12N2 — CID 169185632

IUPAC4,7-dimethyl-6,7-dihydroquinazoline
SMILESCc1ncnc2c1=CCC(C)C=2
InChIInChI=1S/C10H12N2/c1-7-3-4-9-8(2)11-6-12-10(9)5-7/h4-7H,3H2,1-2H3
InChIKeySQKHHIHMFLOTQH-UHFFFAOYSA-N
MW160.22 g/mol
LogP0.39
Rot. Bonds

About 4,7-dimethyl-6,7-dihydroquinazoline

4,7-dimethyl-6,7-dihydroquinazoline (PubChem CID 169185632) has the molecular formula C10H12N2 and a molecular weight of 160.22 g/mol. Its IUPAC name is 4,7-dimethyl-6,7-dihydroquinazoline.

Molecular Properties

Compound Name4,7-dimethyl-6,7-dihydroquinazoline
PubChem CID169185632
Molecular FormulaC10H12N2
Molecular Weight160.22 g/mol
Exact Mass160.10
IUPAC Name4,7-dimethyl-6,7-dihydroquinazoline
SMILESCc1ncnc2c1=CCC(C)C=2
InChIInChI=1S/C10H12N2/c1-7-3-4-9-8(2)11-6-12-10(9)5-7/h4-7H,3H2,1-2H3
InChIKeySQKHHIHMFLOTQH-UHFFFAOYSA-N
XLogP0.39
TPSA25.78 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 ≤ 50.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4,7-dimethyl-6,7-dihydroquinazoline?
The IUPAC name of 4,7-dimethyl-6,7-dihydroquinazoline (CID 169185632) is 4,7-dimethyl-6,7-dihydroquinazoline.
What is the SMILES notation for 4,7-dimethyl-6,7-dihydroquinazoline?
The canonical SMILES for 4,7-dimethyl-6,7-dihydroquinazoline is Cc1ncnc2c1=CCC(C)C=2.
What is the InChIKey of 4,7-dimethyl-6,7-dihydroquinazoline?
The InChIKey is SQKHHIHMFLOTQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2/c1-7-3-4-9-8(2)11-6-12-10(9)5-7/h4-7H,3H2,1-2H3.
What are the key properties of 4,7-dimethyl-6,7-dihydroquinazoline?
4,7-dimethyl-6,7-dihydroquinazoline has a molecular weight of 160.22 g/mol, XLogP of 0.39, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,7-dimethyl-6,7-dihydroquinazoline is sourced from PubChem (CID 169185632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).