2-(4-methylpyrazol-1-yl)-6-pyrrolidin-1-ylpyridine

C13H16N4 — CID 97228379

IUPAC2-(4-methylpyrazol-1-yl)-6-pyrrolidin-1-ylpyridine
SMILESCc1cnn(-c2cccc(N3CCCC3)n2)c1
InChIInChI=1S/C13H16N4/c1-11-9-14-17(10-11)13-6-4-5-12(15-13)16-7-2-3-8-16/h4-6,9-10H,2-3,7-8H2,1H3
InChIKeyONGLXTSHPRMZTR-UHFFFAOYSA-N
MW228.30 g/mol
LogP2.18
Rot. Bonds2

About 2-(4-methylpyrazol-1-yl)-6-pyrrolidin-1-ylpyridine

2-(4-methylpyrazol-1-yl)-6-pyrrolidin-1-ylpyridine (PubChem CID 97228379) has the molecular formula C13H16N4 and a molecular weight of 228.30 g/mol. Its IUPAC name is 2-(4-methylpyrazol-1-yl)-6-pyrrolidin-1-ylpyridine.

Molecular Properties

Compound Name2-(4-methylpyrazol-1-yl)-6-pyrrolidin-1-ylpyridine
PubChem CID97228379
Molecular FormulaC13H16N4
Molecular Weight228.30 g/mol
Exact Mass228.14
IUPAC Name2-(4-methylpyrazol-1-yl)-6-pyrrolidin-1-ylpyridine
SMILESCc1cnn(-c2cccc(N3CCCC3)n2)c1
InChIInChI=1S/C13H16N4/c1-11-9-14-17(10-11)13-6-4-5-12(15-13)16-7-2-3-8-16/h4-6,9-10H,2-3,7-8H2,1H3
InChIKeyONGLXTSHPRMZTR-UHFFFAOYSA-N
XLogP2.18
TPSA33.95 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-Pyridinylmethyl)-1H-pyrazol-5-amine
CID 1096898
5-amino-1-(pyridin-2-yl)-1H-pyrazole-4-carbonitrile
CID 12709883
3-Methyl-1-(pyridin-2-yl)-1H-pyrazol-5-amine
CID 735132
4-methyl-1-(pyridin-3-ylmethyl)-1H-pyrazol-5-amine
CID 1096900
2,6-bis(3-methyl-1H-pyrazol-1-yl)pyridine
CID 850137
Pyridine, 2-(4-aminopyrazol-1-yl)-
CID 206681
1-((pyridin-3-yl)methyl)-1H-pyrazol-5-amine
CID 1096899
2-(3,5-dimethyl-1H-pyrazol-1-yl)pyridine
CID 676764
2-(1H-pyrazol-1-yl)pyridine
CID 5324086
2,6-Di(1-pyrazolyl)pyridine
CID 11816656
1-phenyl-4-(pyrrolidin-1-yl)-1H-pyrazolo[3,4-d]pyrimidine
CID 661192
3-ethyl-7-phenyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine
CID 663772

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylpyrazol-1-yl)-6-pyrrolidin-1-ylpyridine?
The IUPAC name of 2-(4-methylpyrazol-1-yl)-6-pyrrolidin-1-ylpyridine (CID 97228379) is 2-(4-methylpyrazol-1-yl)-6-pyrrolidin-1-ylpyridine.
What is the SMILES notation for 2-(4-methylpyrazol-1-yl)-6-pyrrolidin-1-ylpyridine?
The canonical SMILES for 2-(4-methylpyrazol-1-yl)-6-pyrrolidin-1-ylpyridine is Cc1cnn(-c2cccc(N3CCCC3)n2)c1.
What is the InChIKey of 2-(4-methylpyrazol-1-yl)-6-pyrrolidin-1-ylpyridine?
The InChIKey is ONGLXTSHPRMZTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4/c1-11-9-14-17(10-11)13-6-4-5-12(15-13)16-7-2-3-8-16/h4-6,9-10H,2-3,7-8H2,1H3.
What are the key properties of 2-(4-methylpyrazol-1-yl)-6-pyrrolidin-1-ylpyridine?
2-(4-methylpyrazol-1-yl)-6-pyrrolidin-1-ylpyridine has a molecular weight of 228.30 g/mol, XLogP of 2.18, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylpyrazol-1-yl)-6-pyrrolidin-1-ylpyridine is sourced from PubChem (CID 97228379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).