3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-5-pyridin-2-yl-1H-indole

C19H19N3 — CID 10062773

IUPAC3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-5-pyridin-2-yl-1H-indole
SMILESCN1CC=C(c2c[nH]c3ccc(-c4ccccn4)cc23)CC1
InChIInChI=1S/C19H19N3/c1-22-10-7-14(8-11-22)17-13-21-19-6-5-15(12-16(17)19)18-4-2-3-9-20-18/h2-7,9,12-13,21H,8,10-11H2,1H3
InChIKeyIJOMTNNUIVBSFK-UHFFFAOYSA-N
MW289.38 g/mol
LogP3.95
Rot. Bonds2

About 3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-5-pyridin-2-yl-1H-indole

3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-5-pyridin-2-yl-1H-indole (PubChem CID 10062773) has the molecular formula C19H19N3 and a molecular weight of 289.38 g/mol. Its IUPAC name is 3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-5-pyridin-2-yl-1H-indole.

Molecular Properties

Compound Name3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-5-pyridin-2-yl-1H-indole
PubChem CID10062773
Molecular FormulaC19H19N3
Molecular Weight289.38 g/mol
Exact Mass289.16
IUPAC Name3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-5-pyridin-2-yl-1H-indole
SMILESCN1CC=C(c2c[nH]c3ccc(-c4ccccn4)cc23)CC1
InChIInChI=1S/C19H19N3/c1-22-10-7-14(8-11-22)17-13-21-19-6-5-15(12-16(17)19)18-4-2-3-9-20-18/h2-7,9,12-13,21H,8,10-11H2,1H3
InChIKeyIJOMTNNUIVBSFK-UHFFFAOYSA-N
XLogP3.95
TPSA31.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-5-pyridin-2-yl-1H-indole?
The IUPAC name of 3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-5-pyridin-2-yl-1H-indole (CID 10062773) is 3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-5-pyridin-2-yl-1H-indole.
What is the SMILES notation for 3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-5-pyridin-2-yl-1H-indole?
The canonical SMILES for 3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-5-pyridin-2-yl-1H-indole is CN1CC=C(c2c[nH]c3ccc(-c4ccccn4)cc23)CC1.
What is the InChIKey of 3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-5-pyridin-2-yl-1H-indole?
The InChIKey is IJOMTNNUIVBSFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3/c1-22-10-7-14(8-11-22)17-13-21-19-6-5-15(12-16(17)19)18-4-2-3-9-20-18/h2-7,9,12-13,21H,8,10-11H2,1H3.
What are the key properties of 3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-5-pyridin-2-yl-1H-indole?
3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-5-pyridin-2-yl-1H-indole has a molecular weight of 289.38 g/mol, XLogP of 3.95, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-5-pyridin-2-yl-1H-indole is sourced from PubChem (CID 10062773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).