1-(4-methylphenyl)-9H-indeno[2,1-c]pyridine-4-carbonitrile

C20H14N2 — CID 135012950

IUPAC1-(4-methylphenyl)-9H-indeno[2,1-c]pyridine-4-carbonitrile
SMILESCc1ccc(-c2ncc(C#N)c3c2Cc2ccccc2-3)cc1
InChIInChI=1S/C20H14N2/c1-13-6-8-14(9-7-13)20-18-10-15-4-2-3-5-17(15)19(18)16(11-21)12-22-20/h2-9,12H,10H2,1H3
InChIKeyCDRWLZMLVRAROE-UHFFFAOYSA-N
MW282.35 g/mol
LogP4.50
Rot. Bonds1

About 1-(4-methylphenyl)-9H-indeno[2,1-c]pyridine-4-carbonitrile

1-(4-methylphenyl)-9H-indeno[2,1-c]pyridine-4-carbonitrile (PubChem CID 135012950) has the molecular formula C20H14N2 and a molecular weight of 282.35 g/mol. Its IUPAC name is 1-(4-methylphenyl)-9H-indeno[2,1-c]pyridine-4-carbonitrile.

Molecular Properties

Compound Name1-(4-methylphenyl)-9H-indeno[2,1-c]pyridine-4-carbonitrile
PubChem CID135012950
Molecular FormulaC20H14N2
Molecular Weight282.35 g/mol
Exact Mass282.12
IUPAC Name1-(4-methylphenyl)-9H-indeno[2,1-c]pyridine-4-carbonitrile
SMILESCc1ccc(-c2ncc(C#N)c3c2Cc2ccccc2-3)cc1
InChIInChI=1S/C20H14N2/c1-13-6-8-14(9-7-13)20-18-10-15-4-2-3-5-17(15)19(18)16(11-21)12-22-20/h2-9,12H,10H2,1H3
InChIKeyCDRWLZMLVRAROE-UHFFFAOYSA-N
XLogP4.50
TPSA36.68 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.35
LogP ≤ 54.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 71411540
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5-chloro-4-methyl-6-phenylpyridine-3-carbonitrile
CID 69057731
2-methyl-4-(4-methylsulfanylphenyl)-5H-indeno[1,2-b]pyridine-3-carbonitrile
CID 154644696
2-(5-methylpyrimidin-2-yl)-3-phenylbenzonitrile
CID 58954363
trimethyl-[6-methyl-5-(4-methylphenyl)-11H-benzo[b]fluoren-10-yl]silane
CID 71566789
6-methyl-4-phenylquinoline-3-carbonitrile
CID 141436065
2-methyl-11,12-dihydroindeno[2,1-a]fluorene
CID 91412368
10,13-dimethyltetracyclo[14.4.0.02,7.09,14]icosa-1(20),2,4,6,9,11,13,16,18-nonaene
CID 10755502
2-butanimidoyl-4-(4-methylphenyl)-9H-fluorene-1-carbonitrile
CID 174625908
5-methyl-2-(4-methylphenyl)-3-phenylpyridine
CID 142961722
2-(4-methylphenyl)-5,6-dihydrobenzo[h]quinazoline
CID 123894743

Frequently Asked Questions

What is the IUPAC name of 1-(4-methylphenyl)-9H-indeno[2,1-c]pyridine-4-carbonitrile?
The IUPAC name of 1-(4-methylphenyl)-9H-indeno[2,1-c]pyridine-4-carbonitrile (CID 135012950) is 1-(4-methylphenyl)-9H-indeno[2,1-c]pyridine-4-carbonitrile.
What is the SMILES notation for 1-(4-methylphenyl)-9H-indeno[2,1-c]pyridine-4-carbonitrile?
The canonical SMILES for 1-(4-methylphenyl)-9H-indeno[2,1-c]pyridine-4-carbonitrile is Cc1ccc(-c2ncc(C#N)c3c2Cc2ccccc2-3)cc1.
What is the InChIKey of 1-(4-methylphenyl)-9H-indeno[2,1-c]pyridine-4-carbonitrile?
The InChIKey is CDRWLZMLVRAROE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14N2/c1-13-6-8-14(9-7-13)20-18-10-15-4-2-3-5-17(15)19(18)16(11-21)12-22-20/h2-9,12H,10H2,1H3.
What are the key properties of 1-(4-methylphenyl)-9H-indeno[2,1-c]pyridine-4-carbonitrile?
1-(4-methylphenyl)-9H-indeno[2,1-c]pyridine-4-carbonitrile has a molecular weight of 282.35 g/mol, XLogP of 4.50, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylphenyl)-9H-indeno[2,1-c]pyridine-4-carbonitrile is sourced from PubChem (CID 135012950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).