7,7-dimethyl-6,8-dihydro-4H-quinazoline

C10H14N2 — CID 174588890

IUPAC7,7-dimethyl-6,8-dihydro-4H-quinazoline
SMILESCC1(C)CC=C2CN=CN=C2C1
InChIInChI=1S/C10H14N2/c1-10(2)4-3-8-6-11-7-12-9(8)5-10/h3,7H,4-6H2,1-2H3
InChIKeyWAMXMHKQBDKDAL-UHFFFAOYSA-N
MW162.24 g/mol
LogP2.22
Rot. Bonds

About 7,7-dimethyl-6,8-dihydro-4H-quinazoline

7,7-dimethyl-6,8-dihydro-4H-quinazoline (PubChem CID 174588890) has the molecular formula C10H14N2 and a molecular weight of 162.24 g/mol. Its IUPAC name is 7,7-dimethyl-6,8-dihydro-4H-quinazoline.

Molecular Properties

Compound Name7,7-dimethyl-6,8-dihydro-4H-quinazoline
PubChem CID174588890
Molecular FormulaC10H14N2
Molecular Weight162.24 g/mol
Exact Mass162.12
IUPAC Name7,7-dimethyl-6,8-dihydro-4H-quinazoline
SMILESCC1(C)CC=C2CN=CN=C2C1
InChIInChI=1S/C10H14N2/c1-10(2)4-3-8-6-11-7-12-9(8)5-10/h3,7H,4-6H2,1-2H3
InChIKeyWAMXMHKQBDKDAL-UHFFFAOYSA-N
XLogP2.22
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.24
LogP ≤ 52.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7,7-dimethyl-6,8-dihydro-4H-quinazoline?
The IUPAC name of 7,7-dimethyl-6,8-dihydro-4H-quinazoline (CID 174588890) is 7,7-dimethyl-6,8-dihydro-4H-quinazoline.
What is the SMILES notation for 7,7-dimethyl-6,8-dihydro-4H-quinazoline?
The canonical SMILES for 7,7-dimethyl-6,8-dihydro-4H-quinazoline is CC1(C)CC=C2CN=CN=C2C1.
What is the InChIKey of 7,7-dimethyl-6,8-dihydro-4H-quinazoline?
The InChIKey is WAMXMHKQBDKDAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2/c1-10(2)4-3-8-6-11-7-12-9(8)5-10/h3,7H,4-6H2,1-2H3.
What are the key properties of 7,7-dimethyl-6,8-dihydro-4H-quinazoline?
7,7-dimethyl-6,8-dihydro-4H-quinazoline has a molecular weight of 162.24 g/mol, XLogP of 2.22, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7,7-dimethyl-6,8-dihydro-4H-quinazoline is sourced from PubChem (CID 174588890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).