7-phenyl-2-[2-(7-phenyl-3-propan-2-yl-1H-inden-2-yl)ethyl]-3-propan-2-yl-1H-indene

C38H38 — CID 20656351

IUPAC7-phenyl-2-[2-(7-phenyl-3-propan-2-yl-1H-inden-2-yl)ethyl]-3-propan-2-yl-1H-indene
SMILESCC(C)C1=C(CCC2=C(C(C)C)c3cccc(-c4ccccc4)c3C2)Cc2c1cccc2-c1ccccc1
InChIInChI=1S/C38H38/c1-25(2)37-29(23-35-31(17-11-19-33(35)37)27-13-7-5-8-14-27)21-22-30-24-36-32(28-15-9-6-10-16-28)18-12-20-34(36)38(30)26(3)4/h5-20,25-26H,21-24H2,1-4H3
InChIKeyOXWIKQODWMKRBS-UHFFFAOYSA-N
MW494.72 g/mol
LogP10.43
Rot. Bonds7

About 7-phenyl-2-[2-(7-phenyl-3-propan-2-yl-1H-inden-2-yl)ethyl]-3-propan-2-yl-1H-indene

7-phenyl-2-[2-(7-phenyl-3-propan-2-yl-1H-inden-2-yl)ethyl]-3-propan-2-yl-1H-indene (PubChem CID 20656351) has the molecular formula C38H38 and a molecular weight of 494.72 g/mol. Its IUPAC name is 7-phenyl-2-[2-(7-phenyl-3-propan-2-yl-1H-inden-2-yl)ethyl]-3-propan-2-yl-1H-indene.

Molecular Properties

Compound Name7-phenyl-2-[2-(7-phenyl-3-propan-2-yl-1H-inden-2-yl)ethyl]-3-propan-2-yl-1H-indene
PubChem CID20656351
Molecular FormulaC38H38
Molecular Weight494.72 g/mol
Exact Mass494.30
IUPAC Name7-phenyl-2-[2-(7-phenyl-3-propan-2-yl-1H-inden-2-yl)ethyl]-3-propan-2-yl-1H-indene
SMILESCC(C)C1=C(CCC2=C(C(C)C)c3cccc(-c4ccccc4)c3C2)Cc2c1cccc2-c1ccccc1
InChIInChI=1S/C38H38/c1-25(2)37-29(23-35-31(17-11-19-33(35)37)27-13-7-5-8-14-27)21-22-30-24-36-32(28-15-9-6-10-16-28)18-12-20-34(36)38(30)26(3)4/h5-20,25-26H,21-24H2,1-4H3
InChIKeyOXWIKQODWMKRBS-UHFFFAOYSA-N
XLogP10.43
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500494.72
LogP ≤ 510.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2-ethyl-3-[(2-ethyl-4-phenyl-3H-inden-1-yl)methyl]-7-phenyl-1H-indene
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7-phenyl-2-propan-2-yl-1H-indene
CID 23295619
3-methyl-2-[2-(3-methyl-7-phenyl-1H-inden-2-yl)ethyl]-7-phenyl-1H-indene;2-[2-(3-oxo-7-phenyl-1,2-dihydroinden-2-yl)ethyl]-4-phenyl-2,3-dihydroinden-1-one
CID 159606911
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CID 134509781
ethane;1-phenyl-2-propan-2-ylbenzene
CID 161308506
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CID 20568657
(2-butyl-4-methyl-5-propan-2-ylcyclopenta-1,4-dien-1-yl)benzene
CID 139667609
4-phenyl-2-propan-2-yl-2,3-dihydroinden-1-one
CID 22173366
1-hydroperoxy-3-phenyl-2-propan-2-ylbenzene
CID 139700110
8,8,14,14,22,22-hexamethyl-5-(8-phenyl-9H-fluoren-1-yl)-1-borahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene
CID 159173190
1-[2-(4-phenylphenyl)phenyl]-9H-fluorene
CID 174460318
(Z)-but-2-enedioic acid;1-methyl-4-[2-(2-methyl-4-phenyl-3H-inden-1-yl)ethyl]piperazine
CID 72715713

Frequently Asked Questions

What is the IUPAC name of 7-phenyl-2-[2-(7-phenyl-3-propan-2-yl-1H-inden-2-yl)ethyl]-3-propan-2-yl-1H-indene?
The IUPAC name of 7-phenyl-2-[2-(7-phenyl-3-propan-2-yl-1H-inden-2-yl)ethyl]-3-propan-2-yl-1H-indene (CID 20656351) is 7-phenyl-2-[2-(7-phenyl-3-propan-2-yl-1H-inden-2-yl)ethyl]-3-propan-2-yl-1H-indene.
What is the SMILES notation for 7-phenyl-2-[2-(7-phenyl-3-propan-2-yl-1H-inden-2-yl)ethyl]-3-propan-2-yl-1H-indene?
The canonical SMILES for 7-phenyl-2-[2-(7-phenyl-3-propan-2-yl-1H-inden-2-yl)ethyl]-3-propan-2-yl-1H-indene is CC(C)C1=C(CCC2=C(C(C)C)c3cccc(-c4ccccc4)c3C2)Cc2c1cccc2-c1ccccc1.
What is the InChIKey of 7-phenyl-2-[2-(7-phenyl-3-propan-2-yl-1H-inden-2-yl)ethyl]-3-propan-2-yl-1H-indene?
The InChIKey is OXWIKQODWMKRBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H38/c1-25(2)37-29(23-35-31(17-11-19-33(35)37)27-13-7-5-8-14-27)21-22-30-24-36-32(28-15-9-6-10-16-28)18-12-20-34(36)38(30)26(3)4/h5-20,25-26H,21-24H2,1-4H3.
What are the key properties of 7-phenyl-2-[2-(7-phenyl-3-propan-2-yl-1H-inden-2-yl)ethyl]-3-propan-2-yl-1H-indene?
7-phenyl-2-[2-(7-phenyl-3-propan-2-yl-1H-inden-2-yl)ethyl]-3-propan-2-yl-1H-indene has a molecular weight of 494.72 g/mol, XLogP of 10.43, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7-phenyl-2-[2-(7-phenyl-3-propan-2-yl-1H-inden-2-yl)ethyl]-3-propan-2-yl-1H-indene is sourced from PubChem (CID 20656351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).