2-(4-pyridin-2-yl-2,3-dihydropyrrol-4-yl)pyridine

C14H13N3 — CID 134924533

IUPAC2-(4-pyridin-2-yl-2,3-dihydropyrrol-4-yl)pyridine
SMILESC1=NCCC1(c1ccccn1)c1ccccn1
InChIInChI=1S/C14H13N3/c1-3-8-16-12(5-1)14(7-10-15-11-14)13-6-2-4-9-17-13/h1-6,8-9,11H,7,10H2
InChIKeyXYDALQCWHNFCMS-UHFFFAOYSA-N
MW223.28 g/mol
LogP2.24
Rot. Bonds2

About 2-(4-pyridin-2-yl-2,3-dihydropyrrol-4-yl)pyridine

2-(4-pyridin-2-yl-2,3-dihydropyrrol-4-yl)pyridine (PubChem CID 134924533) has the molecular formula C14H13N3 and a molecular weight of 223.28 g/mol. Its IUPAC name is 2-(4-pyridin-2-yl-2,3-dihydropyrrol-4-yl)pyridine.

Molecular Properties

Compound Name2-(4-pyridin-2-yl-2,3-dihydropyrrol-4-yl)pyridine
PubChem CID134924533
Molecular FormulaC14H13N3
Molecular Weight223.28 g/mol
Exact Mass223.11
IUPAC Name2-(4-pyridin-2-yl-2,3-dihydropyrrol-4-yl)pyridine
SMILESC1=NCCC1(c1ccccn1)c1ccccn1
InChIInChI=1S/C14H13N3/c1-3-8-16-12(5-1)14(7-10-15-11-14)13-6-2-4-9-17-13/h1-6,8-9,11H,7,10H2
InChIKeyXYDALQCWHNFCMS-UHFFFAOYSA-N
XLogP2.24
TPSA38.14 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-pyridin-2-yl-2,3-dihydropyrrol-4-yl)pyridine?
The IUPAC name of 2-(4-pyridin-2-yl-2,3-dihydropyrrol-4-yl)pyridine (CID 134924533) is 2-(4-pyridin-2-yl-2,3-dihydropyrrol-4-yl)pyridine.
What is the SMILES notation for 2-(4-pyridin-2-yl-2,3-dihydropyrrol-4-yl)pyridine?
The canonical SMILES for 2-(4-pyridin-2-yl-2,3-dihydropyrrol-4-yl)pyridine is C1=NCCC1(c1ccccn1)c1ccccn1.
What is the InChIKey of 2-(4-pyridin-2-yl-2,3-dihydropyrrol-4-yl)pyridine?
The InChIKey is XYDALQCWHNFCMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3/c1-3-8-16-12(5-1)14(7-10-15-11-14)13-6-2-4-9-17-13/h1-6,8-9,11H,7,10H2.
What are the key properties of 2-(4-pyridin-2-yl-2,3-dihydropyrrol-4-yl)pyridine?
2-(4-pyridin-2-yl-2,3-dihydropyrrol-4-yl)pyridine has a molecular weight of 223.28 g/mol, XLogP of 2.24, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-pyridin-2-yl-2,3-dihydropyrrol-4-yl)pyridine is sourced from PubChem (CID 134924533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).