4-(6-pyridin-2-yl-3-pyridinyl)aniline

C16H13N3 — CID 129035516

IUPAC4-(6-pyridin-2-yl-3-pyridinyl)aniline
SMILESNc1ccc(-c2ccc(-c3ccccn3)nc2)cc1
InChIInChI=1S/C16H13N3/c17-14-7-4-12(5-8-14)13-6-9-16(19-11-13)15-3-1-2-10-18-15/h1-11H,17H2
InChIKeySPIMQDJTFZWPCB-UHFFFAOYSA-N
MW247.30 g/mol
LogP3.39
Rot. Bonds2

About 4-(6-pyridin-2-yl-3-pyridinyl)aniline

4-(6-pyridin-2-yl-3-pyridinyl)aniline (PubChem CID 129035516) has the molecular formula C16H13N3 and a molecular weight of 247.30 g/mol. Its IUPAC name is 4-(6-pyridin-2-yl-3-pyridinyl)aniline.

Molecular Properties

Compound Name4-(6-pyridin-2-yl-3-pyridinyl)aniline
PubChem CID129035516
Molecular FormulaC16H13N3
Molecular Weight247.30 g/mol
Exact Mass247.11
IUPAC Name4-(6-pyridin-2-yl-3-pyridinyl)aniline
SMILESNc1ccc(-c2ccc(-c3ccccn3)nc2)cc1
InChIInChI=1S/C16H13N3/c17-14-7-4-12(5-8-14)13-6-9-16(19-11-13)15-3-1-2-10-18-15/h1-11H,17H2
InChIKeySPIMQDJTFZWPCB-UHFFFAOYSA-N
XLogP3.39
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.30
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

4-(5-phenyl-2-pyridinyl)aniline
CID 129035533
3-phenyl-5-(6-pyridin-2-yl-3-pyridinyl)pyridine
CID 59724442
2,6-dipyridin-2-yl-4-[4-[3-pyridin-2-yl-5-(6-pyridin-2-yl-3-pyridinyl)phenyl]phenyl]pyridine
CID 126730919
4-(2,3,6-triphenyl-4,5-dipyridin-2-ylphenyl)aniline
CID 132567607
2-pyridin-2-yl-5-(5-pyridin-3-yl-2-pyridinyl)pyridine
CID 100956208
2,4-diphenyl-6-[4-[10-[4-(6-pyridin-2-yl-3-pyridinyl)phenyl]anthracen-9-yl]phenyl]-1,3,5-triazine
CID 165168303
2,4-diphenyl-6-[10-[4-(6-pyridin-2-yl-3-pyridinyl)phenyl]anthracen-9-yl]-1,3,5-triazine
CID 165168236
[4-[7-(6-pyridin-2-yl-3-pyridinyl)naphthalen-2-yl]phenyl]phosphane
CID 170290623
2-[4-(6-pyridin-2-yl-3-pyridinyl)phenyl]acetic acid
CID 170886833
pyridin-4-amine;bis(2-pyridin-2-ylpyridine);ruthenium(2+);dichloride
CID 11180709
bis(pyridin-4-amine);bis(2-pyridin-2-ylpyridine);ruthenium(2+);dichloride
CID 11422486
2-[6-[4-(3,5-diphenylphenyl)-6-pyridin-2-yl-2-pyridinyl]-3-pyridinyl]-4,6-diphenyl-1,3,5-triazine
CID 164817295

Frequently Asked Questions

What is the IUPAC name of 4-(6-pyridin-2-yl-3-pyridinyl)aniline?
The IUPAC name of 4-(6-pyridin-2-yl-3-pyridinyl)aniline (CID 129035516) is 4-(6-pyridin-2-yl-3-pyridinyl)aniline.
What is the SMILES notation for 4-(6-pyridin-2-yl-3-pyridinyl)aniline?
The canonical SMILES for 4-(6-pyridin-2-yl-3-pyridinyl)aniline is Nc1ccc(-c2ccc(-c3ccccn3)nc2)cc1.
What is the InChIKey of 4-(6-pyridin-2-yl-3-pyridinyl)aniline?
The InChIKey is SPIMQDJTFZWPCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N3/c17-14-7-4-12(5-8-14)13-6-9-16(19-11-13)15-3-1-2-10-18-15/h1-11H,17H2.
What are the key properties of 4-(6-pyridin-2-yl-3-pyridinyl)aniline?
4-(6-pyridin-2-yl-3-pyridinyl)aniline has a molecular weight of 247.30 g/mol, XLogP of 3.39, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-pyridin-2-yl-3-pyridinyl)aniline is sourced from PubChem (CID 129035516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).