3-methyl-4-[1-methyl-4-(3-methylphenyl)pyrazol-5-yl]pyridine

C17H17N3 — CID 54318334

IUPAC3-methyl-4-[1-methyl-4-(3-methylphenyl)pyrazol-5-yl]pyridine
SMILESCc1cccc(-c2cnn(C)c2-c2ccncc2C)c1
InChIInChI=1S/C17H17N3/c1-12-5-4-6-14(9-12)16-11-19-20(3)17(16)15-7-8-18-10-13(15)2/h4-11H,1-3H3
InChIKeySPUUTJAGVXPFEI-UHFFFAOYSA-N
MW263.34 g/mol
LogP3.77
Rot. Bonds2

About 3-methyl-4-[1-methyl-4-(3-methylphenyl)pyrazol-5-yl]pyridine

3-methyl-4-[1-methyl-4-(3-methylphenyl)pyrazol-5-yl]pyridine (PubChem CID 54318334) has the molecular formula C17H17N3 and a molecular weight of 263.34 g/mol. Its IUPAC name is 3-methyl-4-[1-methyl-4-(3-methylphenyl)pyrazol-5-yl]pyridine.

Molecular Properties

Compound Name3-methyl-4-[1-methyl-4-(3-methylphenyl)pyrazol-5-yl]pyridine
PubChem CID54318334
Molecular FormulaC17H17N3
Molecular Weight263.34 g/mol
Exact Mass263.14
IUPAC Name3-methyl-4-[1-methyl-4-(3-methylphenyl)pyrazol-5-yl]pyridine
SMILESCc1cccc(-c2cnn(C)c2-c2ccncc2C)c1
InChIInChI=1S/C17H17N3/c1-12-5-4-6-14(9-12)16-11-19-20(3)17(16)15-7-8-18-10-13(15)2/h4-11H,1-3H3
InChIKeySPUUTJAGVXPFEI-UHFFFAOYSA-N
XLogP3.77
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

[3-(3-methylphenyl)-4-pyridinyl]methanol
CID 130118995
N-methyl-3-[1-methyl-4-(3-methylphenyl)pyrazol-5-yl]propan-1-amine
CID 105423631
4-(1,4-dimethylpyrazol-5-yl)pyridin-3-amine
CID 130527491
3-methyl-5-[1-methyl-4-(2-pyridin-3-yl-4-pyridinyl)pyrazol-5-yl]phenol
CID 155805804
2-(1,4-dimethylpyrazol-5-yl)-3-methylpyridine;3-(1,4-dimethylpyrazol-5-yl)-2-methylpyridine;3-(1,4-dimethylpyrazol-5-yl)-4-methylpyridine;4-(1,4-dimethylpyrazol-5-yl)-3-methylpyridine;ethane
CID 163461529
6-(3-methylphenyl)-[1]benzofuro[3,2-c]pyridine
CID 90139219
3-[3-[6-(3-methylphenyl)dibenzofuran-4-yl]-5-pyridin-3-ylphenyl]pyridine
CID 175610202
methylidenephosphane;3-(3-methylphenyl)pyridine
CID 144875841
3-(3-methylphenyl)-[1,2,4]triazolo[4,3-a]pyrazine
CID 67251777
3-methyl-4-[3-(1-pyrrolidin-1-ylethyl)phenyl]pyridine
CID 50959459
4-(3-methylphenyl)quinoline
CID 146587179
3-methyl-4-(2-methylphenyl)pyridine
CID 130153052

Frequently Asked Questions

What is the IUPAC name of 3-methyl-4-[1-methyl-4-(3-methylphenyl)pyrazol-5-yl]pyridine?
The IUPAC name of 3-methyl-4-[1-methyl-4-(3-methylphenyl)pyrazol-5-yl]pyridine (CID 54318334) is 3-methyl-4-[1-methyl-4-(3-methylphenyl)pyrazol-5-yl]pyridine.
What is the SMILES notation for 3-methyl-4-[1-methyl-4-(3-methylphenyl)pyrazol-5-yl]pyridine?
The canonical SMILES for 3-methyl-4-[1-methyl-4-(3-methylphenyl)pyrazol-5-yl]pyridine is Cc1cccc(-c2cnn(C)c2-c2ccncc2C)c1.
What is the InChIKey of 3-methyl-4-[1-methyl-4-(3-methylphenyl)pyrazol-5-yl]pyridine?
The InChIKey is SPUUTJAGVXPFEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3/c1-12-5-4-6-14(9-12)16-11-19-20(3)17(16)15-7-8-18-10-13(15)2/h4-11H,1-3H3.
What are the key properties of 3-methyl-4-[1-methyl-4-(3-methylphenyl)pyrazol-5-yl]pyridine?
3-methyl-4-[1-methyl-4-(3-methylphenyl)pyrazol-5-yl]pyridine has a molecular weight of 263.34 g/mol, XLogP of 3.77, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4-[1-methyl-4-(3-methylphenyl)pyrazol-5-yl]pyridine is sourced from PubChem (CID 54318334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).