ethane;ethenylbenzene;1-ethenyl-2H-naphthalen-2-ide;2-ethenyl-1H-naphthalen-1-ide;3-ethenyl-2H-naphthalen-2-ide;1-ethenyl-2H-phenanthren-2-ide;10-ethenyl-9H-phenanthren-9-ide;3-ethenyl-2H-1,10-phenanthrolin-2-ide;2-ethenyl-3H-pyridin-3-ide;3-ethenyl-2H-pyridin-2-ide;3-ethenyl-6-pyridin-2-yl-2H-pyridin-2-ide;decakis(yttrium)

C156H196N6Y10-20 — CID 162258625

IUPACethane;ethenylbenzene;1-ethenyl-2H-naphthalen-2-ide;2-ethenyl-1H-naphthalen-1-ide;3-ethenyl-2H-naphthalen-2-ide;1-ethenyl-2H-phenanthren-2-ide;10-ethenyl-9H-phenanthren-9-ide;3-ethenyl-2H-1,10-phenanthrolin-2-ide;2-ethenyl-3H-pyridin-3-ide;3-ethenyl-2H-pyridin-2-ide;3-ethenyl-6-pyridin-2-yl-2H-pyridin-2-ide;decakis(yttrium)
SMILESCC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.[H]/[C-]=C/c1[c-]c2ccccc2c2ccccc12.[H]/[C-]=C/c1[c-]c2ccccc2cc1.[H]/[C-]=C/c1[c-]cc2ccccc2c1.[H]/[C-]=C/c1[c-]ccc2c1ccc1ccccc12.[H]/[C-]=C/c1[c-]ccc2ccccc12.[H]/[C-]=C/c1[c-]cccc1.[H]/[C-]=C/c1[c-]cccn1.[H]/[C-]=C/c1[c-]nc(-c2ccccn2)cc1.[H]/[C-]=C/c1[c-]nc2c(ccc3cccnc32)c1.[H]/[C-]=C/c1[c-]nccc1.[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y]
InChIInChI=1S/2C16H10.C14H8N2.C12H8N2.3C12H8.C8H6.2C7H5N.20C2H6.10Y/c1-2-12-11-13-7-3-4-9-15(13)16-10-6-5-8-14(12)16;1-2-12-7-5-9-16-14-8-4-3-6-13(14)10-11-15(12)16;1-2-10-8-12-6-5-11-4-3-7-15-13(11)14(12)16-9-10;1-2-10-6-7-12(14-9-10)11-5-3-4-8-13-11;1-2-10-7-5-8-11-6-3-4-9-12(10)11;2*1-2-10-7-8-11-5-3-4-6-12(11)9-10;1-2-8-6-4-3-5-7-8;1-2-7-4-3-5-8-6-7;1-2-7-5-3-4-6-8-7;20*1-2;;;;;;;;;;/h1-10H;1-6,8-11H;1-8H;1-8H;2*1-6,8-9H;1-8H;1-6H;1-5H;1-4,6H;20*1-2H3;;;;;;;;;;/q10*-2;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;
InChIKeyLJBXWMABHXXHII-UHFFFAOYSA-N
MW3044.39 g/mol
LogP48.24
Rot. Bonds11

About ethane;ethenylbenzene;1-ethenyl-2H-naphthalen-2-ide;2-ethenyl-1H-naphthalen-1-ide;3-ethenyl-2H-naphthalen-2-ide;1-ethenyl-2H-phenanthren-2-ide;10-ethenyl-9H-phenanthren-9-ide;3-ethenyl-2H-1,10-phenanthrolin-2-ide;2-ethenyl-3H-pyridin-3-ide;3-ethenyl-2H-pyridin-2-ide;3-ethenyl-6-pyridin-2-yl-2H-pyridin-2-ide;decakis(yttrium)

ethane;ethenylbenzene;1-ethenyl-2H-naphthalen-2-ide;2-ethenyl-1H-naphthalen-1-ide;3-ethenyl-2H-naphthalen-2-ide;1-ethenyl-2H-phenanthren-2-ide;10-ethenyl-9H-phenanthren-9-ide;3-ethenyl-2H-1,10-phenanthrolin-2-ide;2-ethenyl-3H-pyridin-3-ide;3-ethenyl-2H-pyridin-2-ide;3-ethenyl-6-pyridin-2-yl-2H-pyridin-2-ide;decakis(yttrium) (PubChem CID 162258625) has the molecular formula C156H196N6Y10-20 and a molecular weight of 3044.39 g/mol. Its IUPAC name is ethane;ethenylbenzene;1-ethenyl-2H-naphthalen-2-ide;2-ethenyl-1H-naphthalen-1-ide;3-ethenyl-2H-naphthalen-2-ide;1-ethenyl-2H-phenanthren-2-ide;10-ethenyl-9H-phenanthren-9-ide;3-ethenyl-2H-1,10-phenanthrolin-2-ide;2-ethenyl-3H-pyridin-3-ide;3-ethenyl-2H-pyridin-2-ide;3-ethenyl-6-pyridin-2-yl-2H-pyridin-2-ide;decakis(yttrium).

Molecular Properties

Compound Nameethane;ethenylbenzene;1-ethenyl-2H-naphthalen-2-ide;2-ethenyl-1H-naphthalen-1-ide;3-ethenyl-2H-naphthalen-2-ide;1-ethenyl-2H-phenanthren-2-ide;10-ethenyl-9H-phenanthren-9-ide;3-ethenyl-2H-1,10-phenanthrolin-2-ide;2-ethenyl-3H-pyridin-3-ide;3-ethenyl-2H-pyridin-2-ide;3-ethenyl-6-pyridin-2-yl-2H-pyridin-2-ide;decakis(yttrium)
PubChem CID162258625
Molecular FormulaC156H196N6Y10-20
Molecular Weight3044.39 g/mol
Exact Mass3042.62
IUPAC Nameethane;ethenylbenzene;1-ethenyl-2H-naphthalen-2-ide;2-ethenyl-1H-naphthalen-1-ide;3-ethenyl-2H-naphthalen-2-ide;1-ethenyl-2H-phenanthren-2-ide;10-ethenyl-9H-phenanthren-9-ide;3-ethenyl-2H-1,10-phenanthrolin-2-ide;2-ethenyl-3H-pyridin-3-ide;3-ethenyl-2H-pyridin-2-ide;3-ethenyl-6-pyridin-2-yl-2H-pyridin-2-ide;decakis(yttrium)
SMILESCC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.[H]/[C-]=C/c1[c-]c2ccccc2c2ccccc12.[H]/[C-]=C/c1[c-]c2ccccc2cc1.[H]/[C-]=C/c1[c-]cc2ccccc2c1.[H]/[C-]=C/c1[c-]ccc2c1ccc1ccccc12.[H]/[C-]=C/c1[c-]ccc2ccccc12.[H]/[C-]=C/c1[c-]cccc1.[H]/[C-]=C/c1[c-]cccn1.[H]/[C-]=C/c1[c-]nc(-c2ccccn2)cc1.[H]/[C-]=C/c1[c-]nc2c(ccc3cccnc32)c1.[H]/[C-]=C/c1[c-]nccc1.[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y]
InChIInChI=1S/2C16H10.C14H8N2.C12H8N2.3C12H8.C8H6.2C7H5N.20C2H6.10Y/c1-2-12-11-13-7-3-4-9-15(13)16-10-6-5-8-14(12)16;1-2-12-7-5-9-16-14-8-4-3-6-13(14)10-11-15(12)16;1-2-10-8-12-6-5-11-4-3-7-15-13(11)14(12)16-9-10;1-2-10-6-7-12(14-9-10)11-5-3-4-8-13-11;1-2-10-7-5-8-11-6-3-4-9-12(10)11;2*1-2-10-7-8-11-5-3-4-6-12(11)9-10;1-2-8-6-4-3-5-7-8;1-2-7-4-3-5-8-6-7;1-2-7-5-3-4-6-8-7;20*1-2;;;;;;;;;;/h1-10H;1-6,8-11H;1-8H;1-8H;2*1-6,8-9H;1-8H;1-6H;1-5H;1-4,6H;20*1-2H3;;;;;;;;;;/q10*-2;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;
InChIKeyLJBXWMABHXXHII-UHFFFAOYSA-N
XLogP48.24
TPSA77.34 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds11
Heavy Atoms172
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5003044.39
LogP ≤ 548.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze ethane;ethenylbenzene;1-ethenyl-2H-naphthalen-2-ide;2-ethenyl-1H-naphthalen-1-ide;3-ethenyl-2H-naphthalen-2-ide;1-ethenyl-2H-phenanthren-2-ide;10-ethenyl-9H-phenanthren-9-ide;3-ethenyl-2H-1,10-phenanthrolin-2-ide;2-ethenyl-3H-pyridin-3-ide;3-ethenyl-2H-pyridin-2-ide;3-ethenyl-6-pyridin-2-yl-2H-pyridin-2-ide;decakis(yttrium) with MolForge

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Related Compounds

ethane;6-(2H-pyridin-2-id-3-yl)-7H-isoquinolin-7-ide;7-(2H-pyridin-2-id-3-yl)-6H-isoquinolin-6-ide;3-(2H-pyridin-2-id-3-yl)-2H-1,10-phenanthrolin-2-ide;2-(2H-pyridin-2-id-3-yl)-3H-pyridin-3-ide;2-(3H-pyridin-3-id-2-yl)-3H-pyridin-3-ide;2-(3H-pyridin-3-id-4-yl)-3H-pyridin-3-ide;2-(4H-pyridin-4-id-3-yl)-3H-pyridin-3-ide;3-(2H-pyridin-2-id-3-yl)-4H-pyridin-4-ide;3-(3H-pyridin-3-id-4-yl)-2H-pyridin-2-ide;3-(3H-pyridin-3-id-4-yl)-4H-pyridin-4-ide;3-(4H-pyridin-4-id-3-yl)-4H-pyridin-4-ide;4-(3H-pyridin-3-id-4-yl)-3H-pyridin-3-ide;3-(2H-pyridin-2-id-3-yl)-6-pyridin-2-yl-2H-pyridin-2-ide;3-(2H-pyridin-2-id-3-yl)-2H-quinolin-2-ide;tetradecakis(yttrium)
CID 158197901
3-(2H-naphthalen-2-id-1-yl)-6-pyridin-2-yl-2H-pyridin-2-ide;yttrium
CID 58813552
CID 176583994
CID 176583994
ethane;3-(6H-isoquinolin-6-id-5-yl)-4H-isoquinolin-4-ide;3-(7H-isoquinolin-7-id-8-yl)-4H-isoquinolin-4-ide;4-(7H-isoquinolin-7-id-6-yl)-3H-isoquinolin-3-ide;5-(5H-isoquinolin-5-id-6-yl)-6H-isoquinolin-6-ide;5-(8H-isoquinolin-8-id-7-yl)-6H-isoquinolin-6-ide;6-(7H-isoquinolin-7-id-8-yl)-5H-isoquinolin-5-ide;7-(7H-isoquinolin-7-id-8-yl)-8H-isoquinolin-8-ide;heptakis(yttrium)
CID 157453330
CID 166041879
CID 166041879
1,10-phenanthroline;2-pyridin-2-ylpyridine;2-quinolin-2-ylquinoline;ruthenium(2+)
CID 138986830
CID 177303149
CID 177303149
5-pyridin-2-yl-6,9,15,26-tetrazahexacyclo[12.12.0.02,7.08,13.016,25.018,23]hexacosa-1(26),2(7),3,5,8(13),9,11,14,16,18,20,22,24-tridecaene
CID 102037216
CID 177303105
CID 177303105
dimagnesium;carbanide;ethenylbenzene;methyl(dioxido)borane;yttrium
CID 161426906
ethenylbenzene;2H-isoindole;tungsten(2+)
CID 161337347
1-(9,9-dimethyl-3H-fluoren-3-id-2-yl)isoquinoline;bis(4-hydroxypent-3-en-2-one);tetrakis(iridium);5-methyl-2-phenylquinoline;2-phenyl-1H-naphthalen-1-ide;2-phenylpyridine
CID 160979873

Frequently Asked Questions

What is the IUPAC name of ethane;ethenylbenzene;1-ethenyl-2H-naphthalen-2-ide;2-ethenyl-1H-naphthalen-1-ide;3-ethenyl-2H-naphthalen-2-ide;1-ethenyl-2H-phenanthren-2-ide;10-ethenyl-9H-phenanthren-9-ide;3-ethenyl-2H-1,10-phenanthrolin-2-ide;2-ethenyl-3H-pyridin-3-ide;3-ethenyl-2H-pyridin-2-ide;3-ethenyl-6-pyridin-2-yl-2H-pyridin-2-ide;decakis(yttrium)?
The IUPAC name of ethane;ethenylbenzene;1-ethenyl-2H-naphthalen-2-ide;2-ethenyl-1H-naphthalen-1-ide;3-ethenyl-2H-naphthalen-2-ide;1-ethenyl-2H-phenanthren-2-ide;10-ethenyl-9H-phenanthren-9-ide;3-ethenyl-2H-1,10-phenanthrolin-2-ide;2-ethenyl-3H-pyridin-3-ide;3-ethenyl-2H-pyridin-2-ide;3-ethenyl-6-pyridin-2-yl-2H-pyridin-2-ide;decakis(yttrium) (CID 162258625) is ethane;ethenylbenzene;1-ethenyl-2H-naphthalen-2-ide;2-ethenyl-1H-naphthalen-1-ide;3-ethenyl-2H-naphthalen-2-ide;1-ethenyl-2H-phenanthren-2-ide;10-ethenyl-9H-phenanthren-9-ide;3-ethenyl-2H-1,10-phenanthrolin-2-ide;2-ethenyl-3H-pyridin-3-ide;3-ethenyl-2H-pyridin-2-ide;3-ethenyl-6-pyridin-2-yl-2H-pyridin-2-ide;decakis(yttrium).
What is the SMILES notation for ethane;ethenylbenzene;1-ethenyl-2H-naphthalen-2-ide;2-ethenyl-1H-naphthalen-1-ide;3-ethenyl-2H-naphthalen-2-ide;1-ethenyl-2H-phenanthren-2-ide;10-ethenyl-9H-phenanthren-9-ide;3-ethenyl-2H-1,10-phenanthrolin-2-ide;2-ethenyl-3H-pyridin-3-ide;3-ethenyl-2H-pyridin-2-ide;3-ethenyl-6-pyridin-2-yl-2H-pyridin-2-ide;decakis(yttrium)?
The canonical SMILES for ethane;ethenylbenzene;1-ethenyl-2H-naphthalen-2-ide;2-ethenyl-1H-naphthalen-1-ide;3-ethenyl-2H-naphthalen-2-ide;1-ethenyl-2H-phenanthren-2-ide;10-ethenyl-9H-phenanthren-9-ide;3-ethenyl-2H-1,10-phenanthrolin-2-ide;2-ethenyl-3H-pyridin-3-ide;3-ethenyl-2H-pyridin-2-ide;3-ethenyl-6-pyridin-2-yl-2H-pyridin-2-ide;decakis(yttrium) is CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.[H]/[C-]=C/c1[c-]c2ccccc2c2ccccc12.[H]/[C-]=C/c1[c-]c2ccccc2cc1.[H]/[C-]=C/c1[c-]cc2ccccc2c1.[H]/[C-]=C/c1[c-]ccc2c1ccc1ccccc12.[H]/[C-]=C/c1[c-]ccc2ccccc12.[H]/[C-]=C/c1[c-]cccc1.[H]/[C-]=C/c1[c-]cccn1.[H]/[C-]=C/c1[c-]nc(-c2ccccn2)cc1.[H]/[C-]=C/c1[c-]nc2c(ccc3cccnc32)c1.[H]/[C-]=C/c1[c-]nccc1.[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].
What is the InChIKey of ethane;ethenylbenzene;1-ethenyl-2H-naphthalen-2-ide;2-ethenyl-1H-naphthalen-1-ide;3-ethenyl-2H-naphthalen-2-ide;1-ethenyl-2H-phenanthren-2-ide;10-ethenyl-9H-phenanthren-9-ide;3-ethenyl-2H-1,10-phenanthrolin-2-ide;2-ethenyl-3H-pyridin-3-ide;3-ethenyl-2H-pyridin-2-ide;3-ethenyl-6-pyridin-2-yl-2H-pyridin-2-ide;decakis(yttrium)?
The InChIKey is LJBXWMABHXXHII-UHFFFAOYSA-N. The full InChI is InChI=1S/2C16H10.C14H8N2.C12H8N2.3C12H8.C8H6.2C7H5N.20C2H6.10Y/c1-2-12-11-13-7-3-4-9-15(13)16-10-6-5-8-14(12)16;1-2-12-7-5-9-16-14-8-4-3-6-13(14)10-11-15(12)16;1-2-10-8-12-6-5-11-4-3-7-15-13(11)14(12)16-9-10;1-2-10-6-7-12(14-9-10)11-5-3-4-8-13-11;1-2-10-7-5-8-11-6-3-4-9-12(10)11;2*1-2-10-7-8-11-5-3-4-6-12(11)9-10;1-2-8-6-4-3-5-7-8;1-2-7-4-3-5-8-6-7;1-2-7-5-3-4-6-8-7;20*1-2;;;;;;;;;;/h1-10H;1-6,8-11H;1-8H;1-8H;2*1-6,8-9H;1-8H;1-6H;1-5H;1-4,6H;20*1-2H3;;;;;;;;;;/q10*-2;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;.
What are the key properties of ethane;ethenylbenzene;1-ethenyl-2H-naphthalen-2-ide;2-ethenyl-1H-naphthalen-1-ide;3-ethenyl-2H-naphthalen-2-ide;1-ethenyl-2H-phenanthren-2-ide;10-ethenyl-9H-phenanthren-9-ide;3-ethenyl-2H-1,10-phenanthrolin-2-ide;2-ethenyl-3H-pyridin-3-ide;3-ethenyl-2H-pyridin-2-ide;3-ethenyl-6-pyridin-2-yl-2H-pyridin-2-ide;decakis(yttrium)?
ethane;ethenylbenzene;1-ethenyl-2H-naphthalen-2-ide;2-ethenyl-1H-naphthalen-1-ide;3-ethenyl-2H-naphthalen-2-ide;1-ethenyl-2H-phenanthren-2-ide;10-ethenyl-9H-phenanthren-9-ide;3-ethenyl-2H-1,10-phenanthrolin-2-ide;2-ethenyl-3H-pyridin-3-ide;3-ethenyl-2H-pyridin-2-ide;3-ethenyl-6-pyridin-2-yl-2H-pyridin-2-ide;decakis(yttrium) has a molecular weight of 3044.39 g/mol, XLogP of 48.24, 11 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;ethenylbenzene;1-ethenyl-2H-naphthalen-2-ide;2-ethenyl-1H-naphthalen-1-ide;3-ethenyl-2H-naphthalen-2-ide;1-ethenyl-2H-phenanthren-2-ide;10-ethenyl-9H-phenanthren-9-ide;3-ethenyl-2H-1,10-phenanthrolin-2-ide;2-ethenyl-3H-pyridin-3-ide;3-ethenyl-2H-pyridin-2-ide;3-ethenyl-6-pyridin-2-yl-2H-pyridin-2-ide;decakis(yttrium) is sourced from PubChem (CID 162258625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).