3-(2-methyl-3,4-dihydropyrazol-3-yl)pyridine

C9H11N3 — CID 89058885

IUPAC3-(2-methyl-3,4-dihydropyrazol-3-yl)pyridine
SMILESCN1N=CCC1c1cccnc1
InChIInChI=1S/C9H11N3/c1-12-9(4-6-11-12)8-3-2-5-10-7-8/h2-3,5-7,9H,4H2,1H3
InChIKeyOELXVQNDLABDAL-UHFFFAOYSA-N
MW161.21 g/mol
LogP1.44
Rot. Bonds1

About 3-(2-methyl-3,4-dihydropyrazol-3-yl)pyridine

3-(2-methyl-3,4-dihydropyrazol-3-yl)pyridine (PubChem CID 89058885) has the molecular formula C9H11N3 and a molecular weight of 161.21 g/mol. Its IUPAC name is 3-(2-methyl-3,4-dihydropyrazol-3-yl)pyridine.

Molecular Properties

Compound Name3-(2-methyl-3,4-dihydropyrazol-3-yl)pyridine
PubChem CID89058885
Molecular FormulaC9H11N3
Molecular Weight161.21 g/mol
Exact Mass161.10
IUPAC Name3-(2-methyl-3,4-dihydropyrazol-3-yl)pyridine
SMILESCN1N=CCC1c1cccnc1
InChIInChI=1S/C9H11N3/c1-12-9(4-6-11-12)8-3-2-5-10-7-8/h2-3,5-7,9H,4H2,1H3
InChIKeyOELXVQNDLABDAL-UHFFFAOYSA-N
XLogP1.44
TPSA28.49 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.21
LogP ≤ 51.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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3-(1-methylpyrrolidin-2-yl)pyridine;zinc
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zinc;3-(1-methylpyrrolidin-2-yl)pyridine;oxygen(2-)
CID 157051312
3-(1-methylpyrrolidin-2-yl)pyridine;propane
CID 91386217
N,N-dimethylmethanamine;3-[(2S)-1-methylpyrrolidin-2-yl]pyridine
CID 174560807
copper(1+);3-[(2S)-1-methylpyrrolidin-2-yl]pyridine;cyanide
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Frequently Asked Questions

What is the IUPAC name of 3-(2-methyl-3,4-dihydropyrazol-3-yl)pyridine?
The IUPAC name of 3-(2-methyl-3,4-dihydropyrazol-3-yl)pyridine (CID 89058885) is 3-(2-methyl-3,4-dihydropyrazol-3-yl)pyridine.
What is the SMILES notation for 3-(2-methyl-3,4-dihydropyrazol-3-yl)pyridine?
The canonical SMILES for 3-(2-methyl-3,4-dihydropyrazol-3-yl)pyridine is CN1N=CCC1c1cccnc1.
What is the InChIKey of 3-(2-methyl-3,4-dihydropyrazol-3-yl)pyridine?
The InChIKey is OELXVQNDLABDAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3/c1-12-9(4-6-11-12)8-3-2-5-10-7-8/h2-3,5-7,9H,4H2,1H3.
What are the key properties of 3-(2-methyl-3,4-dihydropyrazol-3-yl)pyridine?
3-(2-methyl-3,4-dihydropyrazol-3-yl)pyridine has a molecular weight of 161.21 g/mol, XLogP of 1.44, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methyl-3,4-dihydropyrazol-3-yl)pyridine is sourced from PubChem (CID 89058885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).