7-methyl-6,7,8,9-tetrahydro-[1,2,4]triazolo[1,5-a]quinazoline

C10H12N4 — CID 4223538

IUPAC7-methyl-6,7,8,9-tetrahydro-[1,2,4]triazolo[1,5-a]quinazoline
SMILESCC1CCc2c(cnc3ncnn23)C1
InChIInChI=1S/C10H12N4/c1-7-2-3-9-8(4-7)5-11-10-12-6-13-14(9)10/h5-7H,2-4H2,1H3
InChIKeyAVSUODQMOHISJB-UHFFFAOYSA-N
MW188.23 g/mol
LogP1.25
Rot. Bonds

About 7-methyl-6,7,8,9-tetrahydro-[1,2,4]triazolo[1,5-a]quinazoline

7-methyl-6,7,8,9-tetrahydro-[1,2,4]triazolo[1,5-a]quinazoline (PubChem CID 4223538) has the molecular formula C10H12N4 and a molecular weight of 188.23 g/mol. Its IUPAC name is 7-methyl-6,7,8,9-tetrahydro-[1,2,4]triazolo[1,5-a]quinazoline.

Molecular Properties

Compound Name7-methyl-6,7,8,9-tetrahydro-[1,2,4]triazolo[1,5-a]quinazoline
PubChem CID4223538
Molecular FormulaC10H12N4
Molecular Weight188.23 g/mol
Exact Mass188.11
IUPAC Name7-methyl-6,7,8,9-tetrahydro-[1,2,4]triazolo[1,5-a]quinazoline
SMILESCC1CCc2c(cnc3ncnn23)C1
InChIInChI=1S/C10H12N4/c1-7-2-3-9-8(4-7)5-11-10-12-6-13-14(9)10/h5-7H,2-4H2,1H3
InChIKeyAVSUODQMOHISJB-UHFFFAOYSA-N
XLogP1.25
TPSA43.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 51.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

6-methyl-N-prop-2-enyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-9-amine
CID 3231155
6,7,8,9-Tetrahydrotetrazolo[1,5-a]quinazoline
CID 2319614
6-(cyclohexylmethyl)-N,N,5-trimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 177377402
2,3,5,7-Tetrazatricyclo[7.6.0.02,6]pentadeca-1(9),3,5,7-tetraene
CID 57327900
7-cyclohexyl-6-methyl-3-(1H-tetrazol-5-yl)pyrazolo[1,5-a]pyrimidine
CID 15958068
4-Methyl-6-[5-(trifluoromethyl)-4,5,6,7-tetra-hydro-2h-indazol-2-yl]pyrimidin-2-amine
CID 129749248
4-(5-Difluoromethyl-4,5,6,7-tetrahydro-2h-indazol-2-yl)-6-methylpyrimidin-2-amine
CID 129749291
1-{5H,6H,7H,8H-[1,2,4]triazolo[3,2-b]quinazolin-9-yl}pyrrolidine
CID 46094469
6,7,8,9-Tetrahydropyrazolo[1,5-a]quinazoline
CID 14472411
5,6,7,8-Tetrahydropyrazolo[5,1-b]quinazoline
CID 129746313
7-Isobutyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidine
CID 129831502
9-(Azonan-1-yl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[5,1-b]quinazoline
CID 46096735

Frequently Asked Questions

What is the IUPAC name of 7-methyl-6,7,8,9-tetrahydro-[1,2,4]triazolo[1,5-a]quinazoline?
The IUPAC name of 7-methyl-6,7,8,9-tetrahydro-[1,2,4]triazolo[1,5-a]quinazoline (CID 4223538) is 7-methyl-6,7,8,9-tetrahydro-[1,2,4]triazolo[1,5-a]quinazoline.
What is the SMILES notation for 7-methyl-6,7,8,9-tetrahydro-[1,2,4]triazolo[1,5-a]quinazoline?
The canonical SMILES for 7-methyl-6,7,8,9-tetrahydro-[1,2,4]triazolo[1,5-a]quinazoline is CC1CCc2c(cnc3ncnn23)C1.
What is the InChIKey of 7-methyl-6,7,8,9-tetrahydro-[1,2,4]triazolo[1,5-a]quinazoline?
The InChIKey is AVSUODQMOHISJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4/c1-7-2-3-9-8(4-7)5-11-10-12-6-13-14(9)10/h5-7H,2-4H2,1H3.
What are the key properties of 7-methyl-6,7,8,9-tetrahydro-[1,2,4]triazolo[1,5-a]quinazoline?
7-methyl-6,7,8,9-tetrahydro-[1,2,4]triazolo[1,5-a]quinazoline has a molecular weight of 188.23 g/mol, XLogP of 1.25, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-6,7,8,9-tetrahydro-[1,2,4]triazolo[1,5-a]quinazoline is sourced from PubChem (CID 4223538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).