1-cyclopropyl-1H-indene

C12H12 — CID 15439193

IUPAC1-cyclopropyl-1H-indene
SMILESC1=CC(C2CC2)c2ccccc21
InChIInChI=1S/C12H12/c1-2-4-11-9(3-1)7-8-12(11)10-5-6-10/h1-4,7-8,10,12H,5-6H2
InChIKeyKFBJGDIFPNUGQI-UHFFFAOYSA-N
MW156.23 g/mol
LogP3.21
Rot. Bonds1

About 1-cyclopropyl-1H-indene

1-cyclopropyl-1H-indene (PubChem CID 15439193) has the molecular formula C12H12 and a molecular weight of 156.23 g/mol. Its IUPAC name is 1-cyclopropyl-1H-indene.

Molecular Properties

Compound Name1-cyclopropyl-1H-indene
PubChem CID15439193
Molecular FormulaC12H12
Molecular Weight156.23 g/mol
Exact Mass156.09
IUPAC Name1-cyclopropyl-1H-indene
SMILESC1=CC(C2CC2)c2ccccc21
InChIInChI=1S/C12H12/c1-2-4-11-9(3-1)7-8-12(11)10-5-6-10/h1-4,7-8,10,12H,5-6H2
InChIKeyKFBJGDIFPNUGQI-UHFFFAOYSA-N
XLogP3.21
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-1H-indene?
The IUPAC name of 1-cyclopropyl-1H-indene (CID 15439193) is 1-cyclopropyl-1H-indene.
What is the SMILES notation for 1-cyclopropyl-1H-indene?
The canonical SMILES for 1-cyclopropyl-1H-indene is C1=CC(C2CC2)c2ccccc21.
What is the InChIKey of 1-cyclopropyl-1H-indene?
The InChIKey is KFBJGDIFPNUGQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12/c1-2-4-11-9(3-1)7-8-12(11)10-5-6-10/h1-4,7-8,10,12H,5-6H2.
What are the key properties of 1-cyclopropyl-1H-indene?
1-cyclopropyl-1H-indene has a molecular weight of 156.23 g/mol, XLogP of 3.21, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-1H-indene is sourced from PubChem (CID 15439193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).