2-(4-propan-2-ylpyrazol-1-yl)pyridine

C11H13N3 — CID 58142776

IUPAC2-(4-propan-2-ylpyrazol-1-yl)pyridine
SMILESCC(C)c1cnn(-c2ccccn2)c1
InChIInChI=1S/C11H13N3/c1-9(2)10-7-13-14(8-10)11-5-3-4-6-12-11/h3-9H,1-2H3
InChIKeyVZICPGPJFYBFDN-UHFFFAOYSA-N
MW187.25 g/mol
LogP2.39
Rot. Bonds2

About 2-(4-propan-2-ylpyrazol-1-yl)pyridine

2-(4-propan-2-ylpyrazol-1-yl)pyridine (PubChem CID 58142776) has the molecular formula C11H13N3 and a molecular weight of 187.25 g/mol. Its IUPAC name is 2-(4-propan-2-ylpyrazol-1-yl)pyridine.

Molecular Properties

Compound Name2-(4-propan-2-ylpyrazol-1-yl)pyridine
PubChem CID58142776
Molecular FormulaC11H13N3
Molecular Weight187.25 g/mol
Exact Mass187.11
IUPAC Name2-(4-propan-2-ylpyrazol-1-yl)pyridine
SMILESCC(C)c1cnn(-c2ccccn2)c1
InChIInChI=1S/C11H13N3/c1-9(2)10-7-13-14(8-10)11-5-3-4-6-12-11/h3-9H,1-2H3
InChIKeyVZICPGPJFYBFDN-UHFFFAOYSA-N
XLogP2.39
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 ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1-pyridin-2-ylpyrazol-4-yl)methyl]propan-2-amine
CID 61272105
N-butan-2-yl-1-pyridin-2-ylpyrazol-4-amine
CID 115922504
N-[(1R)-1-phenylethyl]-1-pyridin-2-ylpyrazole-4-sulfonamide
CID 95738742
6-(4-propan-2-ylpyrazol-1-yl)pyridine-2-carboxylic acid
CID 84694538
2-(4-naphthalen-2-ylpyrazol-1-yl)pyridine
CID 10355830
N-[(1-pyridin-2-ylpyrazol-4-yl)methyl]ethanamine
CID 61271907
1-(2,6-dichlorophenyl)-4-propan-2-ylpyrazole
CID 141189690
1-pyridin-2-ylpyrazole-4-carbonyl chloride
CID 83814309
2-methyl-N-[3-(1-pyridin-2-ylpyrazol-4-yl)propyl]propan-1-amine
CID 55111261
5-propan-2-yl-2-pyridin-2-yl-4,6-dihydropyrrolo[3,4-c]pyrazole
CID 176692287
4-(1-pyridin-2-ylpyrazol-4-yl)quinoline
CID 70689779
2-methoxy-3-methyl-5-(1-pyridin-2-ylpyrazol-4-yl)pyridine
CID 154848621

Frequently Asked Questions

What is the IUPAC name of 2-(4-propan-2-ylpyrazol-1-yl)pyridine?
The IUPAC name of 2-(4-propan-2-ylpyrazol-1-yl)pyridine (CID 58142776) is 2-(4-propan-2-ylpyrazol-1-yl)pyridine.
What is the SMILES notation for 2-(4-propan-2-ylpyrazol-1-yl)pyridine?
The canonical SMILES for 2-(4-propan-2-ylpyrazol-1-yl)pyridine is CC(C)c1cnn(-c2ccccn2)c1.
What is the InChIKey of 2-(4-propan-2-ylpyrazol-1-yl)pyridine?
The InChIKey is VZICPGPJFYBFDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3/c1-9(2)10-7-13-14(8-10)11-5-3-4-6-12-11/h3-9H,1-2H3.
What are the key properties of 2-(4-propan-2-ylpyrazol-1-yl)pyridine?
2-(4-propan-2-ylpyrazol-1-yl)pyridine has a molecular weight of 187.25 g/mol, XLogP of 2.39, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-propan-2-ylpyrazol-1-yl)pyridine is sourced from PubChem (CID 58142776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).