5-[(Z)-2-chloroethenyl]-1H-indole

C10H8ClN — CID 145444556

IUPAC5-[(Z)-2-chloroethenyl]-1H-indole
SMILESCl/C=C\c1ccc2[nH]ccc2c1
InChIInChI=1S/C10H8ClN/c11-5-3-8-1-2-10-9(7-8)4-6-12-10/h1-7,12H/b5-3-
InChIKeyRHRGOINSUJPBPF-HYXAFXHYSA-N
MW177.63 g/mol
LogP3.38
Rot. Bonds1

About 5-[(Z)-2-chloroethenyl]-1H-indole

5-[(Z)-2-chloroethenyl]-1H-indole (PubChem CID 145444556) has the molecular formula C10H8ClN and a molecular weight of 177.63 g/mol. Its IUPAC name is 5-[(Z)-2-chloroethenyl]-1H-indole.

Molecular Properties

Compound Name5-[(Z)-2-chloroethenyl]-1H-indole
PubChem CID145444556
Molecular FormulaC10H8ClN
Molecular Weight177.63 g/mol
Exact Mass177.03
IUPAC Name5-[(Z)-2-chloroethenyl]-1H-indole
SMILESCl/C=C\c1ccc2[nH]ccc2c1
InChIInChI=1S/C10H8ClN/c11-5-3-8-1-2-10-9(7-8)4-6-12-10/h1-7,12H/b5-3-
InChIKeyRHRGOINSUJPBPF-HYXAFXHYSA-N
XLogP3.38
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.63
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Related Compounds

5-[(E)-2-(4-iodophenyl)ethenyl]-1H-indole
CID 135043581
5-(2-pyridin-4-ylethenyl)-1H-indole
CID 54050993
(E)-3-(1H-indol-5-yl)prop-2-en-1-amine
CID 117276942
5-(2-nitroethenyl)-1H-indole
CID 54465016
1-[(E)-2-(1H-indol-5-yl)ethenyl]cyclopentan-1-ol
CID 67724432
5-(4-bromobut-1-enyl)-1H-indole
CID 170497591
4-(1H-indol-5-yl)but-3-en-1-amine
CID 170487084
2-(1H-indol-5-yl)-N-methylethenesulfonamide
CID 54193929
5-(3-azidoprop-1-enyl)-1H-indole
CID 169461878
2-[(E)-2-(1H-indol-5-yl)ethenyl]quinoline
CID 142044528
S-[3-(1H-indol-5-yl)prop-2-enyl] ethanethioate
CID 169457351
2-(1H-indol-5-ylmethylidene)propanedinitrile
CID 5328751

Frequently Asked Questions

What is the IUPAC name of 5-[(Z)-2-chloroethenyl]-1H-indole?
The IUPAC name of 5-[(Z)-2-chloroethenyl]-1H-indole (CID 145444556) is 5-[(Z)-2-chloroethenyl]-1H-indole.
What is the SMILES notation for 5-[(Z)-2-chloroethenyl]-1H-indole?
The canonical SMILES for 5-[(Z)-2-chloroethenyl]-1H-indole is Cl/C=C\c1ccc2[nH]ccc2c1.
What is the InChIKey of 5-[(Z)-2-chloroethenyl]-1H-indole?
The InChIKey is RHRGOINSUJPBPF-HYXAFXHYSA-N. The full InChI is InChI=1S/C10H8ClN/c11-5-3-8-1-2-10-9(7-8)4-6-12-10/h1-7,12H/b5-3-.
What are the key properties of 5-[(Z)-2-chloroethenyl]-1H-indole?
5-[(Z)-2-chloroethenyl]-1H-indole has a molecular weight of 177.63 g/mol, XLogP of 3.38, 1 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(Z)-2-chloroethenyl]-1H-indole is sourced from PubChem (CID 145444556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).