3-ethenyl-1-methyl-2-[(Z)-prop-1-enyl]-4,5-dihydro-1H-indene

C15H18 — CID 142148041

IUPAC3-ethenyl-1-methyl-2-[(Z)-prop-1-enyl]-4,5-dihydro-1H-indene
SMILESC=CC1=C(/C=C\C)C(C)C2=C1CCC=C2
InChIInChI=1S/C15H18/c1-4-8-13-11(3)14-9-6-7-10-15(14)12(13)5-2/h4-6,8-9,11H,2,7,10H2,1,3H3/b8-4-
InChIKeyIPKPQLMDUXRQAJ-YWEYNIOJSA-N
MW198.31 g/mol
LogP4.34
Rot. Bonds2

About 3-ethenyl-1-methyl-2-[(Z)-prop-1-enyl]-4,5-dihydro-1H-indene

3-ethenyl-1-methyl-2-[(Z)-prop-1-enyl]-4,5-dihydro-1H-indene (PubChem CID 142148041) has the molecular formula C15H18 and a molecular weight of 198.31 g/mol. Its IUPAC name is 3-ethenyl-1-methyl-2-[(Z)-prop-1-enyl]-4,5-dihydro-1H-indene.

Molecular Properties

Compound Name3-ethenyl-1-methyl-2-[(Z)-prop-1-enyl]-4,5-dihydro-1H-indene
PubChem CID142148041
Molecular FormulaC15H18
Molecular Weight198.31 g/mol
Exact Mass198.14
IUPAC Name3-ethenyl-1-methyl-2-[(Z)-prop-1-enyl]-4,5-dihydro-1H-indene
SMILESC=CC1=C(/C=C\C)C(C)C2=C1CCC=C2
InChIInChI=1S/C15H18/c1-4-8-13-11(3)14-9-6-7-10-15(14)12(13)5-2/h4-6,8-9,11H,2,7,10H2,1,3H3/b8-4-
InChIKeyIPKPQLMDUXRQAJ-YWEYNIOJSA-N
XLogP4.34
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

4-ethyl-1,2-dimethyl-3-[(Z)-prop-1-enyl]-1,2,5,6-tetrahydronaphthalene
CID 143477485
3-ethenyl-1,1,5-trimethyl-2-[(Z)-prop-1-enyl]-4,5-dihydroindene
CID 156827147
3-ethenyl-2-methyl-4-[(Z)-prop-1-enyl]cyclohepta-1,3,5-triene
CID 156829668
1-[(E)-prop-1-enyl]-2,3,4,5-tetrahydro-1H-indene
CID 142636500
2-[10'-ethenyl-9'-[(Z)-prop-1-enyl]spiro[fluorene-9,8'-tricyclo[9.4.0.02,7]pentadeca-1(11),2,4,6,9,12-hexaene]-4-yl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CID 145092830
2,3-bis(ethenyl)-1-ethyl-7-methyl-4,5-dihydro-1H-indene
CID 144613775
[3,4-bis(ethenyl)-2,5-bis[(Z)-prop-1-enyl]cyclopenta-2,4-dien-1-yl]methanol;ethane
CID 163301264
2-methyltricyclo[10.4.0.03,8]hexadeca-1(16),3(8),4,12,14-pentaene-9,10-dione
CID 155473233
9-[4-[2,3-bis(ethenyl)-1-methylinden-1-yl]-3-ethenyl-2-[(Z)-prop-1-enyl]-7,8-dihydronaphthalen-1-yl]-9-methylfluorene
CID 169131024
9-[4-[2,3-bis(ethenyl)-1-methylinden-1-yl]-3-ethenyl-2-[(Z)-prop-1-enyl]-7,8-dihydronaphthalen-1-yl]-9-methylfluorene;methane
CID 169131023
1,4,5-trimethyl-2,3-bis[(Z)-prop-1-enyl]cyclopenta-1,3-diene
CID 144989599
(3R)-2-ethenyl-3-methyl-1-[(Z)-prop-1-enyl]cyclohexene
CID 145347236

Frequently Asked Questions

What is the IUPAC name of 3-ethenyl-1-methyl-2-[(Z)-prop-1-enyl]-4,5-dihydro-1H-indene?
The IUPAC name of 3-ethenyl-1-methyl-2-[(Z)-prop-1-enyl]-4,5-dihydro-1H-indene (CID 142148041) is 3-ethenyl-1-methyl-2-[(Z)-prop-1-enyl]-4,5-dihydro-1H-indene.
What is the SMILES notation for 3-ethenyl-1-methyl-2-[(Z)-prop-1-enyl]-4,5-dihydro-1H-indene?
The canonical SMILES for 3-ethenyl-1-methyl-2-[(Z)-prop-1-enyl]-4,5-dihydro-1H-indene is C=CC1=C(/C=C\C)C(C)C2=C1CCC=C2.
What is the InChIKey of 3-ethenyl-1-methyl-2-[(Z)-prop-1-enyl]-4,5-dihydro-1H-indene?
The InChIKey is IPKPQLMDUXRQAJ-YWEYNIOJSA-N. The full InChI is InChI=1S/C15H18/c1-4-8-13-11(3)14-9-6-7-10-15(14)12(13)5-2/h4-6,8-9,11H,2,7,10H2,1,3H3/b8-4-.
What are the key properties of 3-ethenyl-1-methyl-2-[(Z)-prop-1-enyl]-4,5-dihydro-1H-indene?
3-ethenyl-1-methyl-2-[(Z)-prop-1-enyl]-4,5-dihydro-1H-indene has a molecular weight of 198.31 g/mol, XLogP of 4.34, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethenyl-1-methyl-2-[(Z)-prop-1-enyl]-4,5-dihydro-1H-indene is sourced from PubChem (CID 142148041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).