2-(6-methyl-3-pyridinyl)-1,3-dihydroisoindole

C14H14N2 — CID 118459671

IUPAC2-(6-methyl-3-pyridinyl)-1,3-dihydroisoindole
SMILESCc1ccc(N2Cc3ccccc3C2)cn1
InChIInChI=1S/C14H14N2/c1-11-6-7-14(8-15-11)16-9-12-4-2-3-5-13(12)10-16/h2-8H,9-10H2,1H3
InChIKeyFGHKLMFSEZEFGQ-UHFFFAOYSA-N
MW210.28 g/mol
LogP2.91
Rot. Bonds1

About 2-(6-methyl-3-pyridinyl)-1,3-dihydroisoindole

2-(6-methyl-3-pyridinyl)-1,3-dihydroisoindole (PubChem CID 118459671) has the molecular formula C14H14N2 and a molecular weight of 210.28 g/mol. Its IUPAC name is 2-(6-methyl-3-pyridinyl)-1,3-dihydroisoindole.

Molecular Properties

Compound Name2-(6-methyl-3-pyridinyl)-1,3-dihydroisoindole
PubChem CID118459671
Molecular FormulaC14H14N2
Molecular Weight210.28 g/mol
Exact Mass210.12
IUPAC Name2-(6-methyl-3-pyridinyl)-1,3-dihydroisoindole
SMILESCc1ccc(N2Cc3ccccc3C2)cn1
InChIInChI=1S/C14H14N2/c1-11-6-7-14(8-15-11)16-9-12-4-2-3-5-13(12)10-16/h2-8H,9-10H2,1H3
InChIKeyFGHKLMFSEZEFGQ-UHFFFAOYSA-N
XLogP2.91
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(6-methyl-3-pyridinyl)-1,3-dihydroisoindole?
The IUPAC name of 2-(6-methyl-3-pyridinyl)-1,3-dihydroisoindole (CID 118459671) is 2-(6-methyl-3-pyridinyl)-1,3-dihydroisoindole.
What is the SMILES notation for 2-(6-methyl-3-pyridinyl)-1,3-dihydroisoindole?
The canonical SMILES for 2-(6-methyl-3-pyridinyl)-1,3-dihydroisoindole is Cc1ccc(N2Cc3ccccc3C2)cn1.
What is the InChIKey of 2-(6-methyl-3-pyridinyl)-1,3-dihydroisoindole?
The InChIKey is FGHKLMFSEZEFGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2/c1-11-6-7-14(8-15-11)16-9-12-4-2-3-5-13(12)10-16/h2-8H,9-10H2,1H3.
What are the key properties of 2-(6-methyl-3-pyridinyl)-1,3-dihydroisoindole?
2-(6-methyl-3-pyridinyl)-1,3-dihydroisoindole has a molecular weight of 210.28 g/mol, XLogP of 2.91, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-methyl-3-pyridinyl)-1,3-dihydroisoindole is sourced from PubChem (CID 118459671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).