3-(2-pyridin-4-ylpyrrol-1-yl)pyridine

C14H11N3 — CID 100914609

IUPAC3-(2-pyridin-4-ylpyrrol-1-yl)pyridine
SMILESc1cncc(-n2cccc2-c2ccncc2)c1
InChIInChI=1S/C14H11N3/c1-3-13(11-16-7-1)17-10-2-4-14(17)12-5-8-15-9-6-12/h1-11H
InChIKeyAVIBXZQRCIBCJG-UHFFFAOYSA-N
MW221.26 g/mol
LogP2.93
Rot. Bonds2

About 3-(2-pyridin-4-ylpyrrol-1-yl)pyridine

3-(2-pyridin-4-ylpyrrol-1-yl)pyridine (PubChem CID 100914609) has the molecular formula C14H11N3 and a molecular weight of 221.26 g/mol. Its IUPAC name is 3-(2-pyridin-4-ylpyrrol-1-yl)pyridine.

Molecular Properties

Compound Name3-(2-pyridin-4-ylpyrrol-1-yl)pyridine
PubChem CID100914609
Molecular FormulaC14H11N3
Molecular Weight221.26 g/mol
Exact Mass221.10
IUPAC Name3-(2-pyridin-4-ylpyrrol-1-yl)pyridine
SMILESc1cncc(-n2cccc2-c2ccncc2)c1
InChIInChI=1S/C14H11N3/c1-3-13(11-16-7-1)17-10-2-4-14(17)12-5-8-15-9-6-12/h1-11H
InChIKeyAVIBXZQRCIBCJG-UHFFFAOYSA-N
XLogP2.93
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 52.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-(1-methyl(213C)pyrrol-2-yl)(2,3,4,5,6-13C5)pyridine
CID 169444700
3-(1-methylpyrrol-2-yl)pyridine
CID 10249
2-bromo-4-(2-pyridin-4-ylpyrrol-1-yl)benzonitrile
CID 134478998
3-(4-methyl-3-pyridin-4-ylpyrazol-1-yl)pyridine
CID 158876961
2-amino-6-pyridin-3-yl-4-(1-pyridin-3-ylpyrrol-2-yl)pyridine-3-carbonitrile
CID 56753845
3-[2-[(2R)-azetidin-2-yl]pyrrol-1-yl]pyridine
CID 55263851
2-oxo-1-pyridin-3-ylpyridine-3-carboxylic acid
CID 21081587
N-ethyl-N-[(1-pyridin-3-ylpyrrol-2-yl)methyl]ethanamine
CID 4277529
1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)-N-[(1-pyridin-3-ylpyrrol-2-yl)methyl]ethanamine
CID 45187858
3-(ethylamino)-1-pyridin-3-ylpyridin-2-one
CID 137457681
4-methyl-3-[2-(4-methylsulfonylphenyl)pyrrol-1-yl]pyridine
CID 21221443
3-imidazol-1-ylpyridine;dihydrochloride
CID 91642740

Frequently Asked Questions

What is the IUPAC name of 3-(2-pyridin-4-ylpyrrol-1-yl)pyridine?
The IUPAC name of 3-(2-pyridin-4-ylpyrrol-1-yl)pyridine (CID 100914609) is 3-(2-pyridin-4-ylpyrrol-1-yl)pyridine.
What is the SMILES notation for 3-(2-pyridin-4-ylpyrrol-1-yl)pyridine?
The canonical SMILES for 3-(2-pyridin-4-ylpyrrol-1-yl)pyridine is c1cncc(-n2cccc2-c2ccncc2)c1.
What is the InChIKey of 3-(2-pyridin-4-ylpyrrol-1-yl)pyridine?
The InChIKey is AVIBXZQRCIBCJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N3/c1-3-13(11-16-7-1)17-10-2-4-14(17)12-5-8-15-9-6-12/h1-11H.
What are the key properties of 3-(2-pyridin-4-ylpyrrol-1-yl)pyridine?
3-(2-pyridin-4-ylpyrrol-1-yl)pyridine has a molecular weight of 221.26 g/mol, XLogP of 2.93, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-pyridin-4-ylpyrrol-1-yl)pyridine is sourced from PubChem (CID 100914609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).