3-(3-pyridin-3-yl-2,4-dipyridin-4-ylcyclobutyl)pyridine

C24H20N4 — CID 139203415

IUPAC3-(3-pyridin-3-yl-2,4-dipyridin-4-ylcyclobutyl)pyridine
SMILESc1cncc(C2C(c3ccncc3)C(c3cccnc3)C2c2ccncc2)c1
InChIInChI=1S/C24H20N4/c1-3-19(15-27-9-1)23-21(17-5-11-25-12-6-17)24(20-4-2-10-28-16-20)22(23)18-7-13-26-14-8-18/h1-16,21-24H
InChIKeyUEPMUYQVWUMKIK-UHFFFAOYSA-N
MW364.45 g/mol
LogP4.72
Rot. Bonds4

About 3-(3-pyridin-3-yl-2,4-dipyridin-4-ylcyclobutyl)pyridine

3-(3-pyridin-3-yl-2,4-dipyridin-4-ylcyclobutyl)pyridine (PubChem CID 139203415) has the molecular formula C24H20N4 and a molecular weight of 364.45 g/mol. Its IUPAC name is 3-(3-pyridin-3-yl-2,4-dipyridin-4-ylcyclobutyl)pyridine.

Molecular Properties

Compound Name3-(3-pyridin-3-yl-2,4-dipyridin-4-ylcyclobutyl)pyridine
PubChem CID139203415
Molecular FormulaC24H20N4
Molecular Weight364.45 g/mol
Exact Mass364.17
IUPAC Name3-(3-pyridin-3-yl-2,4-dipyridin-4-ylcyclobutyl)pyridine
SMILESc1cncc(C2C(c3ccncc3)C(c3cccnc3)C2c2ccncc2)c1
InChIInChI=1S/C24H20N4/c1-3-19(15-27-9-1)23-21(17-5-11-25-12-6-17)24(20-4-2-10-28-16-20)22(23)18-7-13-26-14-8-18/h1-16,21-24H
InChIKeyUEPMUYQVWUMKIK-UHFFFAOYSA-N
XLogP4.72
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.45
LogP ≤ 54.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N,N,N',N'-Tetrakis(2-pyridylmethyl)ethylenediamine
CID 5519
1,3-Bis(4-pyridyl)propane
CID 87019
3-Benzhydrylpyridine
CID 77251
4-Benzhydrylpyridine
CID 77252
Anabasamine
CID 161313
Benzylviologen
CID 14196
1,2-Bis(4-pyridyl)ethane
CID 78630
2-(3-Pyridinyl)-1-azabicyclo(2.2.2)octane
CID 10176454
3,3'-Bipyridine
CID 68487
4,4'-Diphenyl-2,2'-bipyridine
CID 80259
RJR 2429 dihydrochloride
CID 56972204
4-(1,2-Diphenylethyl)pyridine
CID 242919

Frequently Asked Questions

What is the IUPAC name of 3-(3-pyridin-3-yl-2,4-dipyridin-4-ylcyclobutyl)pyridine?
The IUPAC name of 3-(3-pyridin-3-yl-2,4-dipyridin-4-ylcyclobutyl)pyridine (CID 139203415) is 3-(3-pyridin-3-yl-2,4-dipyridin-4-ylcyclobutyl)pyridine.
What is the SMILES notation for 3-(3-pyridin-3-yl-2,4-dipyridin-4-ylcyclobutyl)pyridine?
The canonical SMILES for 3-(3-pyridin-3-yl-2,4-dipyridin-4-ylcyclobutyl)pyridine is c1cncc(C2C(c3ccncc3)C(c3cccnc3)C2c2ccncc2)c1.
What is the InChIKey of 3-(3-pyridin-3-yl-2,4-dipyridin-4-ylcyclobutyl)pyridine?
The InChIKey is UEPMUYQVWUMKIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20N4/c1-3-19(15-27-9-1)23-21(17-5-11-25-12-6-17)24(20-4-2-10-28-16-20)22(23)18-7-13-26-14-8-18/h1-16,21-24H.
What are the key properties of 3-(3-pyridin-3-yl-2,4-dipyridin-4-ylcyclobutyl)pyridine?
3-(3-pyridin-3-yl-2,4-dipyridin-4-ylcyclobutyl)pyridine has a molecular weight of 364.45 g/mol, XLogP of 4.72, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-pyridin-3-yl-2,4-dipyridin-4-ylcyclobutyl)pyridine is sourced from PubChem (CID 139203415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).