1-[di(pyrazol-1-yl)methyl]pyrazole

C10H10N6 — CID 5243808

IUPAC1-[di(pyrazol-1-yl)methyl]pyrazole
SMILESc1cnn(C(n2cccn2)n2cccn2)c1
InChIInChI=1S/C10H10N6/c1-4-11-14(7-1)10(15-8-2-5-12-15)16-9-3-6-13-16/h1-10H
InChIKeyQOHVIMQQEFHOLE-UHFFFAOYSA-N
MW214.23 g/mol
LogP0.83
Rot. Bonds3

About 1-[di(pyrazol-1-yl)methyl]pyrazole

1-[di(pyrazol-1-yl)methyl]pyrazole (PubChem CID 5243808) has the molecular formula C10H10N6 and a molecular weight of 214.23 g/mol. Its IUPAC name is 1-[di(pyrazol-1-yl)methyl]pyrazole.

Molecular Properties

Compound Name1-[di(pyrazol-1-yl)methyl]pyrazole
PubChem CID5243808
Molecular FormulaC10H10N6
Molecular Weight214.23 g/mol
Exact Mass214.10
IUPAC Name1-[di(pyrazol-1-yl)methyl]pyrazole
SMILESc1cnn(C(n2cccn2)n2cccn2)c1
InChIInChI=1S/C10H10N6/c1-4-11-14(7-1)10(15-8-2-5-12-15)16-9-3-6-13-16/h1-10H
InChIKeyQOHVIMQQEFHOLE-UHFFFAOYSA-N
XLogP0.83
TPSA53.46 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.23
LogP ≤ 50.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

1-[di(pyrazol-1-yl)methyl]pyrazole;oxotitanium;dihydrochloride
CID 10980975
2-methylpropane;1-propan-2-ylpyrazole
CID 159283951
pyrazol-1-yl(sulfanyl)methanol
CID 145194827
ethane;2-methylpropane;1-propan-2-ylpyrazole
CID 158347512
1-(1,2,2-trifluoroethyl)pyrazole
CID 175260687
1-(3-methylbutan-2-yl)pyrazole
CID 59320460
copper;1-[di(pyrazol-1-yl)methyl]pyrazole;dibenzoate;hydrate
CID 139206228
1-[(2R)-3,3-dimethylbutan-2-yl]pyrazole
CID 170411970
2-methyl-1-pyrazol-1-ylpropan-1-ol
CID 70596734
1-(1,2,2,2-tetrachloroethyl)pyrazole;hydrochloride
CID 70567368
1-butan-2-ylpyrazole;ethane
CID 170732307
1-(diethoxymethyl)pyrazole
CID 91618471

Frequently Asked Questions

What is the IUPAC name of 1-[di(pyrazol-1-yl)methyl]pyrazole?
The IUPAC name of 1-[di(pyrazol-1-yl)methyl]pyrazole (CID 5243808) is 1-[di(pyrazol-1-yl)methyl]pyrazole.
What is the SMILES notation for 1-[di(pyrazol-1-yl)methyl]pyrazole?
The canonical SMILES for 1-[di(pyrazol-1-yl)methyl]pyrazole is c1cnn(C(n2cccn2)n2cccn2)c1.
What is the InChIKey of 1-[di(pyrazol-1-yl)methyl]pyrazole?
The InChIKey is QOHVIMQQEFHOLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N6/c1-4-11-14(7-1)10(15-8-2-5-12-15)16-9-3-6-13-16/h1-10H.
What are the key properties of 1-[di(pyrazol-1-yl)methyl]pyrazole?
1-[di(pyrazol-1-yl)methyl]pyrazole has a molecular weight of 214.23 g/mol, XLogP of 0.83, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[di(pyrazol-1-yl)methyl]pyrazole is sourced from PubChem (CID 5243808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).