7,7-dimethyl-4,8-dihydro-1H-quinazoline

C10H14N2 — CID 135393541

IUPAC7,7-dimethyl-4,8-dihydro-1H-quinazoline
SMILESCC1(C)C=CC2=C(C1)NC=NC2
InChIInChI=1S/C10H14N2/c1-10(2)4-3-8-6-11-7-12-9(8)5-10/h3-4,7H,5-6H2,1-2H3,(H,11,12)
InChIKeyILFMURVRMYHMMS-UHFFFAOYSA-N
MW162.24 g/mol
LogP1.86
Rot. Bonds

About 7,7-dimethyl-4,8-dihydro-1H-quinazoline

7,7-dimethyl-4,8-dihydro-1H-quinazoline (PubChem CID 135393541) has the molecular formula C10H14N2 and a molecular weight of 162.24 g/mol. Its IUPAC name is 7,7-dimethyl-4,8-dihydro-1H-quinazoline.

Molecular Properties

Compound Name7,7-dimethyl-4,8-dihydro-1H-quinazoline
PubChem CID135393541
Molecular FormulaC10H14N2
Molecular Weight162.24 g/mol
Exact Mass162.12
IUPAC Name7,7-dimethyl-4,8-dihydro-1H-quinazoline
SMILESCC1(C)C=CC2=C(C1)NC=NC2
InChIInChI=1S/C10H14N2/c1-10(2)4-3-8-6-11-7-12-9(8)5-10/h3-4,7H,5-6H2,1-2H3,(H,11,12)
InChIKeyILFMURVRMYHMMS-UHFFFAOYSA-N
XLogP1.86
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.24
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1,4,7,8-Tetrahydroquinazoline
CID 91106721
1,4,5,6-Tetrahydroquinazoline
CID 91430266
1,4,4a,5-Tetrahydroquinazoline
CID 91612703
1,4,5,8-Tetrahydroquinazoline
CID 118369126
8,9-dihydro-1H-perimidine
CID 129044407
8-Methyl-1,4,7,8-tetrahydroquinazoline
CID 135245104
4-Methyl-1,4,5,6-tetrahydroquinazoline
CID 141793082
5-Tert-butyl-6-ethenyl-1,4-dihydropyrimidine
CID 142076458
1,5-Dihydroquinazoline
CID 142336208
1,7-Dihydroquinazoline;ethane
CID 142336209
7-methyl-4-methylidene-5,6,7,8-tetrahydro-3H-pyrido[4,3-d]pyrimidine
CID 142485684
4-Methyl-3,8a-dihydroquinazoline
CID 142987055

Frequently Asked Questions

What is the IUPAC name of 7,7-dimethyl-4,8-dihydro-1H-quinazoline?
The IUPAC name of 7,7-dimethyl-4,8-dihydro-1H-quinazoline (CID 135393541) is 7,7-dimethyl-4,8-dihydro-1H-quinazoline.
What is the SMILES notation for 7,7-dimethyl-4,8-dihydro-1H-quinazoline?
The canonical SMILES for 7,7-dimethyl-4,8-dihydro-1H-quinazoline is CC1(C)C=CC2=C(C1)NC=NC2.
What is the InChIKey of 7,7-dimethyl-4,8-dihydro-1H-quinazoline?
The InChIKey is ILFMURVRMYHMMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2/c1-10(2)4-3-8-6-11-7-12-9(8)5-10/h3-4,7H,5-6H2,1-2H3,(H,11,12).
What are the key properties of 7,7-dimethyl-4,8-dihydro-1H-quinazoline?
7,7-dimethyl-4,8-dihydro-1H-quinazoline has a molecular weight of 162.24 g/mol, XLogP of 1.86, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7,7-dimethyl-4,8-dihydro-1H-quinazoline is sourced from PubChem (CID 135393541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).