3-cyclopropyl-1-[(3-cyclopropyl-1H-inden-1-yl)methyl]-1H-indene

C25H24 — CID 22595407

IUPAC3-cyclopropyl-1-[(3-cyclopropyl-1H-inden-1-yl)methyl]-1H-indene
SMILESC1=C(C2CC2)c2ccccc2C1CC1C=C(C2CC2)c2ccccc21
InChIInChI=1S/C25H24/c1-3-7-22-20(5-1)18(14-24(22)16-9-10-16)13-19-15-25(17-11-12-17)23-8-4-2-6-21(19)23/h1-8,14-19H,9-13H2
InChIKeyQIILLSDNXCBKTN-UHFFFAOYSA-N
MW324.47 g/mol
LogP6.56
Rot. Bonds4

About 3-cyclopropyl-1-[(3-cyclopropyl-1H-inden-1-yl)methyl]-1H-indene

3-cyclopropyl-1-[(3-cyclopropyl-1H-inden-1-yl)methyl]-1H-indene (PubChem CID 22595407) has the molecular formula C25H24 and a molecular weight of 324.47 g/mol. Its IUPAC name is 3-cyclopropyl-1-[(3-cyclopropyl-1H-inden-1-yl)methyl]-1H-indene.

Molecular Properties

Compound Name3-cyclopropyl-1-[(3-cyclopropyl-1H-inden-1-yl)methyl]-1H-indene
PubChem CID22595407
Molecular FormulaC25H24
Molecular Weight324.47 g/mol
Exact Mass324.19
IUPAC Name3-cyclopropyl-1-[(3-cyclopropyl-1H-inden-1-yl)methyl]-1H-indene
SMILESC1=C(C2CC2)c2ccccc2C1CC1C=C(C2CC2)c2ccccc21
InChIInChI=1S/C25H24/c1-3-7-22-20(5-1)18(14-24(22)16-9-10-16)13-19-15-25(17-11-12-17)23-8-4-2-6-21(19)23/h1-8,14-19H,9-13H2
InChIKeyQIILLSDNXCBKTN-UHFFFAOYSA-N
XLogP6.56
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500324.47
LogP ≤ 56.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

CID 521817
CID 521817
CID 20735
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CID 274386
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CID 15203
CID 15203
CID 69753
CID 69753
CID 260967
CID 260967
CID 5354120
CID 5354120
CID 3033855
CID 3033855
CID 569074
CID 569074
CID 275896
CID 275896
CID 105960
CID 105960
CID 22924
CID 22924

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-1-[(3-cyclopropyl-1H-inden-1-yl)methyl]-1H-indene?
The IUPAC name of 3-cyclopropyl-1-[(3-cyclopropyl-1H-inden-1-yl)methyl]-1H-indene (CID 22595407) is 3-cyclopropyl-1-[(3-cyclopropyl-1H-inden-1-yl)methyl]-1H-indene.
What is the SMILES notation for 3-cyclopropyl-1-[(3-cyclopropyl-1H-inden-1-yl)methyl]-1H-indene?
The canonical SMILES for 3-cyclopropyl-1-[(3-cyclopropyl-1H-inden-1-yl)methyl]-1H-indene is C1=C(C2CC2)c2ccccc2C1CC1C=C(C2CC2)c2ccccc21.
What is the InChIKey of 3-cyclopropyl-1-[(3-cyclopropyl-1H-inden-1-yl)methyl]-1H-indene?
The InChIKey is QIILLSDNXCBKTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24/c1-3-7-22-20(5-1)18(14-24(22)16-9-10-16)13-19-15-25(17-11-12-17)23-8-4-2-6-21(19)23/h1-8,14-19H,9-13H2.
What are the key properties of 3-cyclopropyl-1-[(3-cyclopropyl-1H-inden-1-yl)methyl]-1H-indene?
3-cyclopropyl-1-[(3-cyclopropyl-1H-inden-1-yl)methyl]-1H-indene has a molecular weight of 324.47 g/mol, XLogP of 6.56, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-1-[(3-cyclopropyl-1H-inden-1-yl)methyl]-1H-indene is sourced from PubChem (CID 22595407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).