CID 158478788

C18H15InN — CID 158478788

IUPAC—
SMILESCc1ccc(-c2ccccc2-c2ccccn2)cc1.[In]
InChIInChI=1S/C18H15N.In/c1-14-9-11-15(12-10-14)16-6-2-3-7-17(16)18-8-4-5-13-19-18;/h2-13H,1H3;
InChIKeyHHGOLKNAXMSLQA-UHFFFAOYSA-N
MW360.14 g/mol
LogP4.34
Rot. Bonds2

About CID 158478788

CID 158478788 (PubChem CID 158478788) has the molecular formula C18H15InN and a molecular weight of 360.14 g/mol.

Molecular Properties

Compound NameCID 158478788
PubChem CID158478788
Molecular FormulaC18H15InN
Molecular Weight360.14 g/mol
Exact Mass360.02
IUPAC Name—
SMILESCc1ccc(-c2ccccc2-c2ccccn2)cc1.[In]
InChIInChI=1S/C18H15N.In/c1-14-9-11-15(12-10-14)16-6-2-3-7-17(16)18-8-4-5-13-19-18;/h2-13H,1H3;
InChIKeyHHGOLKNAXMSLQA-UHFFFAOYSA-N
XLogP4.34
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.14
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-(4-methylphenyl)-2-pyridin-2-ylpyridine
CID 138756955
2-(4-methyl-2-phenylphenyl)pyridine
CID 20606677
2-(4-methylphenyl)pyridine;silver
CID 121395993
iridium;tris(2-[4-(4-methylphenyl)phenyl]pyridine)
CID 173084530
2-methyl-5-(2-pyridin-2-ylphenyl)aniline
CID 135030637
2-(2-methylphenyl)pyridine
CID 144596153
2-[4-(2-pyridin-2-ylphenyl)phenyl]ethanol
CID 135030639
2-[2,3-bis[4-[2,5-dipyridin-2-yl-3,4-bis[4-(2,3,4,5-tetraphenylphenyl)phenyl]phenyl]phenyl]-6-[4-[2-[4-[3-[4-[2,5-dipyridin-2-yl-3,4-bis[4-(2,3,4,5-tetraphenylphenyl)phenyl]phenyl]phenyl]-4-[4-[2,5-dipyridin-2-yl-4-[4-(2,3,4,5-tetraphenylphenyl)phenyl]-3-[4-(2,3,4,5-tetraphenyl-6-pyridin-2-ylphenyl)phenyl]phenyl]phenyl]-2,5-dipyridin-2-ylphenyl]phenyl]-4-(4-methylphenyl)-3,6-dipyridin-2-ylphenyl]phenyl]-4-pyridin-2-ylphenyl]pyridine
CID 58114875
2-chloro-3-(4-methylphenyl)pyridine
CID 82076857
2-(2,4-dimethylphenyl)pyridine;ethane
CID 143636710
4-[4-[2-[4-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]phenyl]phenyl]phenyl]-2,6-dipyridin-2-ylpyridine
CID 122364716
1-methyl-3,5-bis(3-phenylphenyl)benzene;1-(3-methylphenyl)-3,5-diphenylbenzene;1-(4-methylphenyl)-3,5-diphenylbenzene;2-(2-methyl-3-pyridin-2-ylphenyl)pyridine;2-methyl-1,3,5-triphenylbenzene
CID 157324380

Frequently Asked Questions

What is the IUPAC name of CID 158478788?
The IUPAC name of CID 158478788 (CID 158478788) is not available.
What is the SMILES notation for CID 158478788?
The canonical SMILES for CID 158478788 is Cc1ccc(-c2ccccc2-c2ccccn2)cc1.[In].
What is the InChIKey of CID 158478788?
The InChIKey is HHGOLKNAXMSLQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N.In/c1-14-9-11-15(12-10-14)16-6-2-3-7-17(16)18-8-4-5-13-19-18;/h2-13H,1H3;.
What are the key properties of CID 158478788?
CID 158478788 has a molecular weight of 360.14 g/mol, XLogP of 4.34, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 158478788 is sourced from PubChem (CID 158478788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).