3-[(Z)-but-2-en-2-yl]-2-methyl-1H-indene

C14H16 — CID 142104556

IUPAC3-[(Z)-but-2-en-2-yl]-2-methyl-1H-indene
SMILESC/C=C(/C)C1=C(C)Cc2ccccc21
InChIInChI=1S/C14H16/c1-4-10(2)14-11(3)9-12-7-5-6-8-13(12)14/h4-8H,9H2,1-3H3/b10-4-
InChIKeyGRIGVIQEQLKXOP-WMZJFQQLSA-N
MW184.28 g/mol
LogP3.98
Rot. Bonds1

About 3-[(Z)-but-2-en-2-yl]-2-methyl-1H-indene

3-[(Z)-but-2-en-2-yl]-2-methyl-1H-indene (PubChem CID 142104556) has the molecular formula C14H16 and a molecular weight of 184.28 g/mol. Its IUPAC name is 3-[(Z)-but-2-en-2-yl]-2-methyl-1H-indene.

Molecular Properties

Compound Name3-[(Z)-but-2-en-2-yl]-2-methyl-1H-indene
PubChem CID142104556
Molecular FormulaC14H16
Molecular Weight184.28 g/mol
Exact Mass184.13
IUPAC Name3-[(Z)-but-2-en-2-yl]-2-methyl-1H-indene
SMILESC/C=C(/C)C1=C(C)Cc2ccccc21
InChIInChI=1S/C14H16/c1-4-10(2)14-11(3)9-12-7-5-6-8-13(12)14/h4-8H,9H2,1-3H3/b10-4-
InChIKeyGRIGVIQEQLKXOP-WMZJFQQLSA-N
XLogP3.98
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 53.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 3-[(Z)-but-2-en-2-yl]-2-methyl-1H-indene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,3-dimethyl-1H-indene;ethane
CID 54108652
lithium;2,3-dimethyl-1H-indene;hydride
CID 174422478
3H-indene-1,2-diol
CID 69341367
2-methyl-3-[2-(2-methyl-3H-inden-1-yl)propan-2-yl]-1H-indene
CID 18369858
dichlorozirconium;2,3-dimethyl-1H-indene
CID 174258147
N-[dimethyl-(2-methyl-3H-inden-1-yl)silyl]methanamine
CID 162293765
9H-fluoren-1-ol;prop-1-ene
CID 159607408
acetic acid;azane;9H-fluorene
CID 174966259
2,6-dimethylbenzene-1,4-diol;9H-fluorene
CID 162146644
9H-fluorene;formic acid
CID 175878260
cadmium;9H-fluorene
CID 175337736
azane;hexakis(9H-fluorene)
CID 158472914

Frequently Asked Questions

What is the IUPAC name of 3-[(Z)-but-2-en-2-yl]-2-methyl-1H-indene?
The IUPAC name of 3-[(Z)-but-2-en-2-yl]-2-methyl-1H-indene (CID 142104556) is 3-[(Z)-but-2-en-2-yl]-2-methyl-1H-indene.
What is the SMILES notation for 3-[(Z)-but-2-en-2-yl]-2-methyl-1H-indene?
The canonical SMILES for 3-[(Z)-but-2-en-2-yl]-2-methyl-1H-indene is C/C=C(/C)C1=C(C)Cc2ccccc21.
What is the InChIKey of 3-[(Z)-but-2-en-2-yl]-2-methyl-1H-indene?
The InChIKey is GRIGVIQEQLKXOP-WMZJFQQLSA-N. The full InChI is InChI=1S/C14H16/c1-4-10(2)14-11(3)9-12-7-5-6-8-13(12)14/h4-8H,9H2,1-3H3/b10-4-.
What are the key properties of 3-[(Z)-but-2-en-2-yl]-2-methyl-1H-indene?
3-[(Z)-but-2-en-2-yl]-2-methyl-1H-indene has a molecular weight of 184.28 g/mol, XLogP of 3.98, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(Z)-but-2-en-2-yl]-2-methyl-1H-indene is sourced from PubChem (CID 142104556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).