2-butyl-7-ethyl-3H-pyrazolo[1,5-b][1,2,4]triazole

C10H16N4 — CID 19002209

IUPAC2-butyl-7-ethyl-3H-pyrazolo[1,5-b][1,2,4]triazole
SMILESCCCCc1nc2c(CC)cnn2[nH]1
InChIInChI=1S/C10H16N4/c1-3-5-6-9-12-10-8(4-2)7-11-14(10)13-9/h7H,3-6H2,1-2H3,(H,12,13)
InChIKeyVHVVWTWNBZXBAW-UHFFFAOYSA-N
MW192.27 g/mol
LogP1.96
Rot. Bonds4

About 2-butyl-7-ethyl-3H-pyrazolo[1,5-b][1,2,4]triazole

2-butyl-7-ethyl-3H-pyrazolo[1,5-b][1,2,4]triazole (PubChem CID 19002209) has the molecular formula C10H16N4 and a molecular weight of 192.27 g/mol. Its IUPAC name is 2-butyl-7-ethyl-3H-pyrazolo[1,5-b][1,2,4]triazole.

Molecular Properties

Compound Name2-butyl-7-ethyl-3H-pyrazolo[1,5-b][1,2,4]triazole
PubChem CID19002209
Molecular FormulaC10H16N4
Molecular Weight192.27 g/mol
Exact Mass192.14
IUPAC Name2-butyl-7-ethyl-3H-pyrazolo[1,5-b][1,2,4]triazole
SMILESCCCCc1nc2c(CC)cnn2[nH]1
InChIInChI=1S/C10H16N4/c1-3-5-6-9-12-10-8(4-2)7-11-14(10)13-9/h7H,3-6H2,1-2H3,(H,12,13)
InChIKeyVHVVWTWNBZXBAW-UHFFFAOYSA-N
XLogP1.96
TPSA45.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.27
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

7-butyl-2-ethyl-3H-pyrazolo[1,5-b][1,2,4]triazole
CID 10559663
7-chloro-2-ethyl-3H-pyrazolo[1,5-b][1,2,4]triazole
CID 19002119
5-butyl-4-ethyl-1H-pyrazole
CID 147341447
8-butyl-3-methyl-7H-purine-2,6-dione
CID 112568989
2-butyl-5-propyl-1H-imidazole
CID 68810469
2-butyl-5-phenyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one
CID 155559035
4-(3-sulfanylidene-5-tridecyl-1H-1,2,4-triazol-2-yl)benzenesulfonamide
CID 91519389
2-butyl-6-ethylpyrazine
CID 91862985
4-butyl-5-ethyl-2-methyl-3-propylpyridine
CID 144533680
2-butyl-1H-pyrimidin-6-one
CID 10511035
7-chloro-3,6-diethyl-5-methylpyrazolo[1,5-a]pyrimidine
CID 104621763
2-butyl-1H-imidazole;hydrochloride
CID 141134528

Frequently Asked Questions

What is the IUPAC name of 2-butyl-7-ethyl-3H-pyrazolo[1,5-b][1,2,4]triazole?
The IUPAC name of 2-butyl-7-ethyl-3H-pyrazolo[1,5-b][1,2,4]triazole (CID 19002209) is 2-butyl-7-ethyl-3H-pyrazolo[1,5-b][1,2,4]triazole.
What is the SMILES notation for 2-butyl-7-ethyl-3H-pyrazolo[1,5-b][1,2,4]triazole?
The canonical SMILES for 2-butyl-7-ethyl-3H-pyrazolo[1,5-b][1,2,4]triazole is CCCCc1nc2c(CC)cnn2[nH]1.
What is the InChIKey of 2-butyl-7-ethyl-3H-pyrazolo[1,5-b][1,2,4]triazole?
The InChIKey is VHVVWTWNBZXBAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4/c1-3-5-6-9-12-10-8(4-2)7-11-14(10)13-9/h7H,3-6H2,1-2H3,(H,12,13).
What are the key properties of 2-butyl-7-ethyl-3H-pyrazolo[1,5-b][1,2,4]triazole?
2-butyl-7-ethyl-3H-pyrazolo[1,5-b][1,2,4]triazole has a molecular weight of 192.27 g/mol, XLogP of 1.96, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butyl-7-ethyl-3H-pyrazolo[1,5-b][1,2,4]triazole is sourced from PubChem (CID 19002209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).