(2Z)-2-ethylidene-1-(2-methylbutan-2-yl)-1,3-dihydroindene

C16H22 — CID 144899057

IUPAC(2Z)-2-ethylidene-1-(2-methylbutan-2-yl)-1,3-dihydroindene
SMILESC/C=C1/Cc2ccccc2C1C(C)(C)CC
InChIInChI=1S/C16H22/c1-5-12-11-13-9-7-8-10-14(13)15(12)16(3,4)6-2/h5,7-10,15H,6,11H2,1-4H3/b12-5-
InChIKeyYWWVVRJLOUANBH-XGICHPGQSA-N
MW214.35 g/mol
LogP4.71
Rot. Bonds2

About (2Z)-2-ethylidene-1-(2-methylbutan-2-yl)-1,3-dihydroindene

(2Z)-2-ethylidene-1-(2-methylbutan-2-yl)-1,3-dihydroindene (PubChem CID 144899057) has the molecular formula C16H22 and a molecular weight of 214.35 g/mol. Its IUPAC name is (2Z)-2-ethylidene-1-(2-methylbutan-2-yl)-1,3-dihydroindene.

Molecular Properties

Compound Name(2Z)-2-ethylidene-1-(2-methylbutan-2-yl)-1,3-dihydroindene
PubChem CID144899057
Molecular FormulaC16H22
Molecular Weight214.35 g/mol
Exact Mass214.17
IUPAC Name(2Z)-2-ethylidene-1-(2-methylbutan-2-yl)-1,3-dihydroindene
SMILESC/C=C1/Cc2ccccc2C1C(C)(C)CC
InChIInChI=1S/C16H22/c1-5-12-11-13-9-7-8-10-14(13)15(12)16(3,4)6-2/h5,7-10,15H,6,11H2,1-4H3/b12-5-
InChIKeyYWWVVRJLOUANBH-XGICHPGQSA-N
XLogP4.71
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 54.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-(2,2-dimethylbutyl)-9,10-dihydroanthracen-9-amine
CID 103460480
6-tert-butyl-5-(2-methylbutan-2-yl)-6,7,8,9-tetrahydro-5H-benzo[7]annulene
CID 167617330
9-(2-methylbutan-2-yl)-9H-fluoren-4-ol
CID 162129903
1-(2-methylbutan-2-yl)-2-phenyl-3,4-dihydro-1H-isoquinoline
CID 162415451
8-tert-butyltetracyclo[13.1.1.02,7.09,14]heptadeca-2,4,6,9,11,13-hexaene
CID 155609294
11-tert-butyl-6,11-dihydrobenzo[c][1]benzothiepine;ethane
CID 165013159
2-tert-butyl-9,9-difluorotricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaene
CID 134297905
7-ethenylbicyclo[4.2.0]octa-1,3,5-triene;hexa-1,4-diene
CID 160724552
methyl 2-[(2Z)-2-(hydroxymethylidene)-1,3-dihydroinden-1-yl]acetate
CID 23567246
(E)-(1-phenyl-1,3-dihydroinden-2-ylidene)methanol
CID 101182639
2-tert-butyltricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaene;(2,2-dimethyl-1-phenylpropyl)benzene;ethane;methane
CID 160572501
2-ethyl-3-(2-methylbutan-2-yl)-1,2,3,4-tetrahydronaphthalene;propan-2-amine
CID 142059776

Frequently Asked Questions

What is the IUPAC name of (2Z)-2-ethylidene-1-(2-methylbutan-2-yl)-1,3-dihydroindene?
The IUPAC name of (2Z)-2-ethylidene-1-(2-methylbutan-2-yl)-1,3-dihydroindene (CID 144899057) is (2Z)-2-ethylidene-1-(2-methylbutan-2-yl)-1,3-dihydroindene.
What is the SMILES notation for (2Z)-2-ethylidene-1-(2-methylbutan-2-yl)-1,3-dihydroindene?
The canonical SMILES for (2Z)-2-ethylidene-1-(2-methylbutan-2-yl)-1,3-dihydroindene is C/C=C1/Cc2ccccc2C1C(C)(C)CC.
What is the InChIKey of (2Z)-2-ethylidene-1-(2-methylbutan-2-yl)-1,3-dihydroindene?
The InChIKey is YWWVVRJLOUANBH-XGICHPGQSA-N. The full InChI is InChI=1S/C16H22/c1-5-12-11-13-9-7-8-10-14(13)15(12)16(3,4)6-2/h5,7-10,15H,6,11H2,1-4H3/b12-5-.
What are the key properties of (2Z)-2-ethylidene-1-(2-methylbutan-2-yl)-1,3-dihydroindene?
(2Z)-2-ethylidene-1-(2-methylbutan-2-yl)-1,3-dihydroindene has a molecular weight of 214.35 g/mol, XLogP of 4.71, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-2-ethylidene-1-(2-methylbutan-2-yl)-1,3-dihydroindene is sourced from PubChem (CID 144899057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).