2,6-bis(pyrazol-1-ylmethyl)pyridine

C13H13N5 — CID 12975814

IUPAC2,6-bis(pyrazol-1-ylmethyl)pyridine
SMILESc1cc(Cn2cccn2)nc(Cn2cccn2)c1
InChIInChI=1S/C13H13N5/c1-4-12(10-17-8-2-6-14-17)16-13(5-1)11-18-9-3-7-15-18/h1-9H,10-11H2
InChIKeyAXERATVALSKSIV-UHFFFAOYSA-N
MW239.28 g/mol
LogP1.57
Rot. Bonds4

About 2,6-bis(pyrazol-1-ylmethyl)pyridine

2,6-bis(pyrazol-1-ylmethyl)pyridine (PubChem CID 12975814) has the molecular formula C13H13N5 and a molecular weight of 239.28 g/mol. Its IUPAC name is 2,6-bis(pyrazol-1-ylmethyl)pyridine.

Molecular Properties

Compound Name2,6-bis(pyrazol-1-ylmethyl)pyridine
PubChem CID12975814
Molecular FormulaC13H13N5
Molecular Weight239.28 g/mol
Exact Mass239.12
IUPAC Name2,6-bis(pyrazol-1-ylmethyl)pyridine
SMILESc1cc(Cn2cccn2)nc(Cn2cccn2)c1
InChIInChI=1S/C13H13N5/c1-4-12(10-17-8-2-6-14-17)16-13(5-1)11-18-9-3-7-15-18/h1-9H,10-11H2
InChIKeyAXERATVALSKSIV-UHFFFAOYSA-N
XLogP1.57
TPSA48.53 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 51.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-[[6-(pyrazol-1-ylmethyl)-2-pyridinyl]methyl]propan-2-amine
CID 106907352
N-propyl-6-(pyrazol-1-ylmethyl)pyridin-2-amine
CID 79232077
1-[[2,3,4,5,6-pentakis(pyrazol-1-ylmethyl)phenyl]methyl]pyrazole
CID 15190545
4-methyl-2-(pyrazol-1-ylmethyl)-6-(pyrrol-1-ylmethyl)pyridine
CID 59685582
1-[(2,6-dimethylphenyl)methyl]pyrazole
CID 79032553
2,6-bis(1,2,4-triazol-1-ylmethyl)pyridine
CID 102265098
2,6-bis[(5-methyl-2H-pyrrol-2-id-1-yl)methyl]pyridine;iridium(3+);1-[[3-(pyrazol-1-ylmethyl)benzene-2-id-1-yl]methyl]pyrazole
CID 59685631
1-[[1,3,4,5,6,7,8-heptakis(pyrazol-1-ylmethyl)biphenylen-2-yl]methyl]pyrazole
CID 139060151
4-(pyrazol-1-ylmethyl)-2H-triazole
CID 154029465
2-methyl-4-(pyrazol-1-ylmethyl)triazole
CID 130588297
7-[(6-methyl-2-pyridinyl)methyl]-2-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
CID 97467474
1-[(4-ethylphenyl)methyl]pyrazole
CID 63811734

Frequently Asked Questions

What is the IUPAC name of 2,6-bis(pyrazol-1-ylmethyl)pyridine?
The IUPAC name of 2,6-bis(pyrazol-1-ylmethyl)pyridine (CID 12975814) is 2,6-bis(pyrazol-1-ylmethyl)pyridine.
What is the SMILES notation for 2,6-bis(pyrazol-1-ylmethyl)pyridine?
The canonical SMILES for 2,6-bis(pyrazol-1-ylmethyl)pyridine is c1cc(Cn2cccn2)nc(Cn2cccn2)c1.
What is the InChIKey of 2,6-bis(pyrazol-1-ylmethyl)pyridine?
The InChIKey is AXERATVALSKSIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N5/c1-4-12(10-17-8-2-6-14-17)16-13(5-1)11-18-9-3-7-15-18/h1-9H,10-11H2.
What are the key properties of 2,6-bis(pyrazol-1-ylmethyl)pyridine?
2,6-bis(pyrazol-1-ylmethyl)pyridine has a molecular weight of 239.28 g/mol, XLogP of 1.57, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-bis(pyrazol-1-ylmethyl)pyridine is sourced from PubChem (CID 12975814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).