5,6-dimethyl-4,5-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine

C7H10N4 — CID 135976745

IUPAC5,6-dimethyl-4,5-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine
SMILESCC1=Cn2ncnc2NC1C
InChIInChI=1S/C7H10N4/c1-5-3-11-7(8-4-9-11)10-6(5)2/h3-4,6H,1-2H3,(H,8,9,10)
InChIKeyOACRXXWXJFWALD-UHFFFAOYSA-N
MW150.18 g/mol
LogP0.95
Rot. Bonds

About 5,6-dimethyl-4,5-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine

5,6-dimethyl-4,5-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine (PubChem CID 135976745) has the molecular formula C7H10N4 and a molecular weight of 150.18 g/mol. Its IUPAC name is 5,6-dimethyl-4,5-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name5,6-dimethyl-4,5-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine
PubChem CID135976745
Molecular FormulaC7H10N4
Molecular Weight150.18 g/mol
Exact Mass150.09
IUPAC Name5,6-dimethyl-4,5-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine
SMILESCC1=Cn2ncnc2NC1C
InChIInChI=1S/C7H10N4/c1-5-3-11-7(8-4-9-11)10-6(5)2/h3-4,6H,1-2H3,(H,8,9,10)
InChIKeyOACRXXWXJFWALD-UHFFFAOYSA-N
XLogP0.95
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.18
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-Methyl-4,5-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine
CID 136196381
2-[(Z)-1-aminobut-1-en-2-yl]-1,2,4-triazol-3-amine
CID 145221182
3-(1,2,4-Triazol-1-ylmethyl)but-3-en-1-amine
CID 156254750
5,7-Dimethyl-4,5-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine
CID 169006543
5,6-Dimethyl-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine
CID 173341710
2-(5-Methyl-4,5-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanamine
CID 136313050
6-Methyl-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine
CID 136694502
6-Isopropyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine
CID 136694503
7-Methyl-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine
CID 136694505
7-Isopropyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine
CID 136694506
(5-Methyl-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)methanamine
CID 136801027
(5,7-Dimethyl-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)methanamine
CID 136801028

Frequently Asked Questions

What is the IUPAC name of 5,6-dimethyl-4,5-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine?
The IUPAC name of 5,6-dimethyl-4,5-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine (CID 135976745) is 5,6-dimethyl-4,5-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine.
What is the SMILES notation for 5,6-dimethyl-4,5-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine?
The canonical SMILES for 5,6-dimethyl-4,5-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine is CC1=Cn2ncnc2NC1C.
What is the InChIKey of 5,6-dimethyl-4,5-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine?
The InChIKey is OACRXXWXJFWALD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N4/c1-5-3-11-7(8-4-9-11)10-6(5)2/h3-4,6H,1-2H3,(H,8,9,10).
What are the key properties of 5,6-dimethyl-4,5-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine?
5,6-dimethyl-4,5-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine has a molecular weight of 150.18 g/mol, XLogP of 0.95, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dimethyl-4,5-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine is sourced from PubChem (CID 135976745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).