2-[(3,5-dimethylpyrazol-1-yl)methyl]pyridine

C11H13N3 — CID 12988154

IUPAC2-[(3,5-dimethylpyrazol-1-yl)methyl]pyridine
SMILESCc1cc(C)n(Cc2ccccn2)n1
InChIInChI=1S/C11H13N3/c1-9-7-10(2)14(13-9)8-11-5-3-4-6-12-11/h3-7H,8H2,1-2H3
InChIKeyRVVDTAGINJPVFP-UHFFFAOYSA-N
MW187.25 g/mol
LogP1.94
Rot. Bonds2

About 2-[(3,5-dimethylpyrazol-1-yl)methyl]pyridine

2-[(3,5-dimethylpyrazol-1-yl)methyl]pyridine (PubChem CID 12988154) has the molecular formula C11H13N3 and a molecular weight of 187.25 g/mol. Its IUPAC name is 2-[(3,5-dimethylpyrazol-1-yl)methyl]pyridine.

Molecular Properties

Compound Name2-[(3,5-dimethylpyrazol-1-yl)methyl]pyridine
PubChem CID12988154
Molecular FormulaC11H13N3
Molecular Weight187.25 g/mol
Exact Mass187.11
IUPAC Name2-[(3,5-dimethylpyrazol-1-yl)methyl]pyridine
SMILESCc1cc(C)n(Cc2ccccn2)n1
InChIInChI=1S/C11H13N3/c1-9-7-10(2)14(13-9)8-11-5-3-4-6-12-11/h3-7H,8H2,1-2H3
InChIKeyRVVDTAGINJPVFP-UHFFFAOYSA-N
XLogP1.94
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.25
LogP ≤ 51.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-methyl-2-(pyridin-2-ylmethyl)pyrazole-3-carboxylic acid
CID 83534624
2-[[5-(4-fluorophenyl)-3-methylpyrazol-1-yl]methyl]pyridine
CID 59281597
3-(3,5-dimethylpyrazol-1-yl)-N-(pyridin-2-ylmethyl)propan-1-amine
CID 115572659
3-(3,5-dimethylpyrazol-1-yl)-N-(2-pyridin-2-ylethyl)propan-1-amine
CID 115571467
4-[(3,5-dimethylpyrazol-1-yl)methyl]-N-methyl-N-(pyridin-2-ylmethyl)benzamide
CID 49024423
copper;2-[(3,5-dimethylpyrazol-1-yl)methyl]-6-[6-[(3,5-dimethylpyrazol-1-yl)methyl]-2-pyridinyl]pyridine;dibromide;trihydrate
CID 139151836
8-[(3,5-dimethylpyrazol-1-yl)methyl]quinoline
CID 60982843
1-[bis(pyridin-2-ylmethyl)amino]-3-[2-(3,5-dimethylpyrazol-1-yl)ethoxy]propan-2-ol
CID 15831001
2-chloro-4-[(3,5-dimethylpyrazol-1-yl)methyl]pyridine
CID 62471489
1-[(2-methoxyphenyl)methyl]-3,5-dimethylpyrazole
CID 63810139
[3-[(3,5-dimethylpyrazol-1-yl)methyl]phenyl]-[3-(pyridin-2-ylmethyl)pyrrolidin-1-yl]methanone
CID 166618279
2-[(2S)-3-(3,5-dimethylpyrazol-1-yl)-2-methylpropyl]-1-(2-pyridin-2-ylethyl)guanidine
CID 95761539

Frequently Asked Questions

What is the IUPAC name of 2-[(3,5-dimethylpyrazol-1-yl)methyl]pyridine?
The IUPAC name of 2-[(3,5-dimethylpyrazol-1-yl)methyl]pyridine (CID 12988154) is 2-[(3,5-dimethylpyrazol-1-yl)methyl]pyridine.
What is the SMILES notation for 2-[(3,5-dimethylpyrazol-1-yl)methyl]pyridine?
The canonical SMILES for 2-[(3,5-dimethylpyrazol-1-yl)methyl]pyridine is Cc1cc(C)n(Cc2ccccn2)n1.
What is the InChIKey of 2-[(3,5-dimethylpyrazol-1-yl)methyl]pyridine?
The InChIKey is RVVDTAGINJPVFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3/c1-9-7-10(2)14(13-9)8-11-5-3-4-6-12-11/h3-7H,8H2,1-2H3.
What are the key properties of 2-[(3,5-dimethylpyrazol-1-yl)methyl]pyridine?
2-[(3,5-dimethylpyrazol-1-yl)methyl]pyridine has a molecular weight of 187.25 g/mol, XLogP of 1.94, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3,5-dimethylpyrazol-1-yl)methyl]pyridine is sourced from PubChem (CID 12988154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).