5-[1-(2-methyl-4-pyridinyl)ethenyl]-1H-indole

C16H14N2 — CID 162671651

IUPAC5-[1-(2-methyl-4-pyridinyl)ethenyl]-1H-indole
SMILESC=C(c1ccnc(C)c1)c1ccc2[nH]ccc2c1
InChIInChI=1S/C16H14N2/c1-11-9-14(5-7-17-11)12(2)13-3-4-16-15(10-13)6-8-18-16/h3-10,18H,2H2,1H3
InChIKeyIYUIEZANVHFDAC-UHFFFAOYSA-N
MW234.30 g/mol
LogP3.93
Rot. Bonds2

About 5-[1-(2-methyl-4-pyridinyl)ethenyl]-1H-indole

5-[1-(2-methyl-4-pyridinyl)ethenyl]-1H-indole (PubChem CID 162671651) has the molecular formula C16H14N2 and a molecular weight of 234.30 g/mol. Its IUPAC name is 5-[1-(2-methyl-4-pyridinyl)ethenyl]-1H-indole.

Molecular Properties

Compound Name5-[1-(2-methyl-4-pyridinyl)ethenyl]-1H-indole
PubChem CID162671651
Molecular FormulaC16H14N2
Molecular Weight234.30 g/mol
Exact Mass234.12
IUPAC Name5-[1-(2-methyl-4-pyridinyl)ethenyl]-1H-indole
SMILESC=C(c1ccnc(C)c1)c1ccc2[nH]ccc2c1
InChIInChI=1S/C16H14N2/c1-11-9-14(5-7-17-11)12(2)13-3-4-16-15(10-13)6-8-18-16/h3-10,18H,2H2,1H3
InChIKeyIYUIEZANVHFDAC-UHFFFAOYSA-N
XLogP3.93
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

methanol;2-methyl-4-prop-1-en-2-ylpyridine
CID 165117502
ethane;2-methyl-4-prop-1-en-2-ylpyridine
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1-[2-[1-(1H-indol-5-yl)ethenyl]phenyl]-N,N-dimethylmethanamine
CID 89110567
methyl 1H-indole-5-carboxylate;pyridine
CID 175088239
N-(3-methyl-4-pyridinyl)-1H-indole-5-carboxamide
CID 63719010
1H-indol-5-yl-[4-[2-(2-methylimidazol-1-yl)ethyl]piperazin-1-yl]methanone
CID 90533855
5-[(3Z)-penta-1,3-dien-2-yl]-1H-pyrrolo[2,3-b]pyridine
CID 145220213
(2R)-1-(1H-indol-5-yl)-2-(methylamino)propan-1-one
CID 97056556
N-[1-(4-fluorophenyl)ethenyl]-1H-indol-5-amine
CID 142618850
N-(5-methyl-1H-pyrazol-4-yl)-1H-indole-5-carboxamide
CID 112521790
ethane;1-(1H-indol-5-yl)-4-pyridin-3-ylbutane-1,4-dione
CID 144689405
1-[4-(1H-indol-5-yl)phenyl]ethanone
CID 82039796

Frequently Asked Questions

What is the IUPAC name of 5-[1-(2-methyl-4-pyridinyl)ethenyl]-1H-indole?
The IUPAC name of 5-[1-(2-methyl-4-pyridinyl)ethenyl]-1H-indole (CID 162671651) is 5-[1-(2-methyl-4-pyridinyl)ethenyl]-1H-indole.
What is the SMILES notation for 5-[1-(2-methyl-4-pyridinyl)ethenyl]-1H-indole?
The canonical SMILES for 5-[1-(2-methyl-4-pyridinyl)ethenyl]-1H-indole is C=C(c1ccnc(C)c1)c1ccc2[nH]ccc2c1.
What is the InChIKey of 5-[1-(2-methyl-4-pyridinyl)ethenyl]-1H-indole?
The InChIKey is IYUIEZANVHFDAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2/c1-11-9-14(5-7-17-11)12(2)13-3-4-16-15(10-13)6-8-18-16/h3-10,18H,2H2,1H3.
What are the key properties of 5-[1-(2-methyl-4-pyridinyl)ethenyl]-1H-indole?
5-[1-(2-methyl-4-pyridinyl)ethenyl]-1H-indole has a molecular weight of 234.30 g/mol, XLogP of 3.93, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-(2-methyl-4-pyridinyl)ethenyl]-1H-indole is sourced from PubChem (CID 162671651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).