1H-indole;1-methoxy-4-prop-1-enylbenzene

C18H19NO — CID 67195673

IUPAC1H-indole;1-methoxy-4-prop-1-enylbenzene
SMILESCC=Cc1ccc(OC)cc1.c1ccc2[nH]ccc2c1
InChIInChI=1S/C10H12O.C8H7N/c1-3-4-9-5-7-10(11-2)8-6-9;1-2-4-8-7(3-1)5-6-9-8/h3-8H,1-2H3;1-6,9H
InChIKeyCJOBXRICJQEFRI-UHFFFAOYSA-N
MW265.36 g/mol
LogP4.90
Rot. Bonds2

About 1H-indole;1-methoxy-4-prop-1-enylbenzene

1H-indole;1-methoxy-4-prop-1-enylbenzene (PubChem CID 67195673) has the molecular formula C18H19NO and a molecular weight of 265.36 g/mol. Its IUPAC name is 1H-indole;1-methoxy-4-prop-1-enylbenzene.

Molecular Properties

Compound Name1H-indole;1-methoxy-4-prop-1-enylbenzene
PubChem CID67195673
Molecular FormulaC18H19NO
Molecular Weight265.36 g/mol
Exact Mass265.15
IUPAC Name1H-indole;1-methoxy-4-prop-1-enylbenzene
SMILESCC=Cc1ccc(OC)cc1.c1ccc2[nH]ccc2c1
InChIInChI=1S/C10H12O.C8H7N/c1-3-4-9-5-7-10(11-2)8-6-9;1-2-4-8-7(3-1)5-6-9-8/h3-8H,1-2H3;1-6,9H
InChIKeyCJOBXRICJQEFRI-UHFFFAOYSA-N
XLogP4.90
TPSA25.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 54.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-methoxy-4-prop-1-enylbenzene
CID 67322568
acetaldehyde;1H-indole
CID 22501409
ethane;1H-indole;methane
CID 169425426
1H-indole;dihydrochloride
CID 18796541
dithiirane-3-thione;1-methoxy-4-prop-1-enylbenzene
CID 175445582
disodium;tris(1H-indole);sulfide
CID 67840647
6-[(Z)-2-(3,5-dimethoxyphenyl)ethenyl]-1H-indole
CID 25050334
1-methoxy-4-[2-[4-[2-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]ethenyl]phenyl]ethenyl]benzene
CID 76573307
5-(4-methoxyphenoxy)-1H-indole
CID 19042832
CID 175434437
CID 175434437
ethane;2-[(E)-2-(4-methoxyphenyl)ethenyl]-1H-indole
CID 143581960
1H-indole;oxozinc
CID 174920230

Frequently Asked Questions

What is the IUPAC name of 1H-indole;1-methoxy-4-prop-1-enylbenzene?
The IUPAC name of 1H-indole;1-methoxy-4-prop-1-enylbenzene (CID 67195673) is 1H-indole;1-methoxy-4-prop-1-enylbenzene.
What is the SMILES notation for 1H-indole;1-methoxy-4-prop-1-enylbenzene?
The canonical SMILES for 1H-indole;1-methoxy-4-prop-1-enylbenzene is CC=Cc1ccc(OC)cc1.c1ccc2[nH]ccc2c1.
What is the InChIKey of 1H-indole;1-methoxy-4-prop-1-enylbenzene?
The InChIKey is CJOBXRICJQEFRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12O.C8H7N/c1-3-4-9-5-7-10(11-2)8-6-9;1-2-4-8-7(3-1)5-6-9-8/h3-8H,1-2H3;1-6,9H.
What are the key properties of 1H-indole;1-methoxy-4-prop-1-enylbenzene?
1H-indole;1-methoxy-4-prop-1-enylbenzene has a molecular weight of 265.36 g/mol, XLogP of 4.90, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1H-indole;1-methoxy-4-prop-1-enylbenzene is sourced from PubChem (CID 67195673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).