8-methyl-6,7-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrimidine

C6H10N4 — CID 89209622

IUPAC8-methyl-6,7-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrimidine
SMILESCN1CCCn2cnnc21
InChIInChI=1S/C6H10N4/c1-9-3-2-4-10-5-7-8-6(9)10/h5H,2-4H2,1H3
InChIKeyHVFVRQXFBRIWOA-UHFFFAOYSA-N
MW138.17 g/mol
LogP0.12
Rot. Bonds

About 8-methyl-6,7-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrimidine

8-methyl-6,7-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrimidine (PubChem CID 89209622) has the molecular formula C6H10N4 and a molecular weight of 138.17 g/mol. Its IUPAC name is 8-methyl-6,7-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrimidine.

Molecular Properties

Compound Name8-methyl-6,7-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrimidine
PubChem CID89209622
Molecular FormulaC6H10N4
Molecular Weight138.17 g/mol
Exact Mass138.09
IUPAC Name8-methyl-6,7-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrimidine
SMILESCN1CCCn2cnnc21
InChIInChI=1S/C6H10N4/c1-9-3-2-4-10-5-7-8-6(9)10/h5H,2-4H2,1H3
InChIKeyHVFVRQXFBRIWOA-UHFFFAOYSA-N
XLogP0.12
TPSA33.95 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 50.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4H,5H,6H,7H-[1,2,4]triazolo[1,5-a]pyrimidine
CID 135704509
4-Propyl-4H-1,2,4-triazole
CID 12888376
1-(4-Methyl-1,2,4-triazol-3-yl)piperidine
CID 21854916
8-propan-2-yl-6,7-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrimidine
CID 57530988
6-methyl-7,8-dihydro-5H-[1,2,4]triazolo[4,3-c]pyrimidine
CID 58759691
N-butyl-N-methyl-[1,2,4]triazolo[4,3-a][1,3,5]triazin-5-amine
CID 91070862
4-Methyl-1-propyl-1,2,4-triazol-4-ium
CID 101372320
N,N-dimethyl-3-(1,2,4-triazol-1-yl)propan-1-amine
CID 115585376
5,6,7,8-Tetrahydro-[1,2,4]triazolo[4,3-a]pyrimidine
CID 136308660
Methyl-[3-(1-methyl-1,2,4-triazol-4-ium-4-yl)propyl]-dipropylazanium
CID 141949317
ethane;8-ethyl-6,7-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrimidine
CID 142619172
8-(2,2-dimethylpropyl)-6,7-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrimidine
CID 143797435

Frequently Asked Questions

What is the IUPAC name of 8-methyl-6,7-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrimidine?
The IUPAC name of 8-methyl-6,7-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrimidine (CID 89209622) is 8-methyl-6,7-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrimidine.
What is the SMILES notation for 8-methyl-6,7-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrimidine?
The canonical SMILES for 8-methyl-6,7-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrimidine is CN1CCCn2cnnc21.
What is the InChIKey of 8-methyl-6,7-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrimidine?
The InChIKey is HVFVRQXFBRIWOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N4/c1-9-3-2-4-10-5-7-8-6(9)10/h5H,2-4H2,1H3.
What are the key properties of 8-methyl-6,7-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrimidine?
8-methyl-6,7-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrimidine has a molecular weight of 138.17 g/mol, XLogP of 0.12, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-6,7-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrimidine is sourced from PubChem (CID 89209622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).