4-(3-chloroazulen-1-yl)pyridine

C15H10ClN — CID 127025394

IUPAC4-(3-chloroazulen-1-yl)pyridine
SMILESClc1cc(-c2ccncc2)c2cccccc1-2
InChIInChI=1S/C15H10ClN/c16-15-10-14(11-6-8-17-9-7-11)12-4-2-1-3-5-13(12)15/h1-10H
InChIKeyBSPKIQUOLYUMNV-UHFFFAOYSA-N
MW239.71 g/mol
LogP4.51
Rot. Bonds1

About 4-(3-chloroazulen-1-yl)pyridine

4-(3-chloroazulen-1-yl)pyridine (PubChem CID 127025394) has the molecular formula C15H10ClN and a molecular weight of 239.71 g/mol. Its IUPAC name is 4-(3-chloroazulen-1-yl)pyridine.

Molecular Properties

Compound Name4-(3-chloroazulen-1-yl)pyridine
PubChem CID127025394
Molecular FormulaC15H10ClN
Molecular Weight239.71 g/mol
Exact Mass239.05
IUPAC Name4-(3-chloroazulen-1-yl)pyridine
SMILESClc1cc(-c2ccncc2)c2cccccc1-2
InChIInChI=1S/C15H10ClN/c16-15-10-14(11-6-8-17-9-7-11)12-4-2-1-3-5-13(12)15/h1-10H
InChIKeyBSPKIQUOLYUMNV-UHFFFAOYSA-N
XLogP4.51
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.71
LogP ≤ 54.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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1,2,4-trichloro-5-phenylbenzene
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3-chloro-6-phenyl-4-pyridin-4-ylpyridazine
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4-(2-chloro-4-methylphenyl)pyridine
CID 46317056
2-[4-(2,5-diphenylphenyl)-3-phenylphenyl]-4,6-dipyridin-4-yl-1,3,5-triazine
CID 146187499
sulfane;bis(1,2,4-trichloro-5-phenylbenzene)
CID 173160003
1-(2-chloro-4,5-diphenylphenyl)fluoren-9-one
CID 130380056
2-[4-[2-(2-naphthalen-2-ylphenyl)phenyl]-3-phenylphenyl]-4,6-dipyridin-4-yl-1,3,5-triazine
CID 146187775
2,4-bis(4-phenylphenyl)-6-[3-(2-phenylphenyl)-5-pyridin-4-ylphenyl]-1,3,5-triazine
CID 155595102
3-(2-chlorophenyl)-4-pyridin-4-ylpyridazine
CID 69275479
4-[2-[1,2,2-tris(2-pyridin-4-ylphenyl)ethenyl]phenyl]pyridine
CID 123619493

Frequently Asked Questions

What is the IUPAC name of 4-(3-chloroazulen-1-yl)pyridine?
The IUPAC name of 4-(3-chloroazulen-1-yl)pyridine (CID 127025394) is 4-(3-chloroazulen-1-yl)pyridine.
What is the SMILES notation for 4-(3-chloroazulen-1-yl)pyridine?
The canonical SMILES for 4-(3-chloroazulen-1-yl)pyridine is Clc1cc(-c2ccncc2)c2cccccc1-2.
What is the InChIKey of 4-(3-chloroazulen-1-yl)pyridine?
The InChIKey is BSPKIQUOLYUMNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10ClN/c16-15-10-14(11-6-8-17-9-7-11)12-4-2-1-3-5-13(12)15/h1-10H.
What are the key properties of 4-(3-chloroazulen-1-yl)pyridine?
4-(3-chloroazulen-1-yl)pyridine has a molecular weight of 239.71 g/mol, XLogP of 4.51, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-chloroazulen-1-yl)pyridine is sourced from PubChem (CID 127025394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).