2-cyclopropyl-5,6-dimethyl-1H-indene

C14H16 — CID 167541438

IUPAC2-cyclopropyl-5,6-dimethyl-1H-indene
SMILESCc1cc2c(cc1C)CC(C1CC1)=C2
InChIInChI=1S/C14H16/c1-9-5-12-7-14(11-3-4-11)8-13(12)6-10(9)2/h5-7,11H,3-4,8H2,1-2H3
InChIKeyJTADBUYAWKHTHU-UHFFFAOYSA-N
MW184.28 g/mol
LogP3.65
Rot. Bonds1

About 2-cyclopropyl-5,6-dimethyl-1H-indene

2-cyclopropyl-5,6-dimethyl-1H-indene (PubChem CID 167541438) has the molecular formula C14H16 and a molecular weight of 184.28 g/mol. Its IUPAC name is 2-cyclopropyl-5,6-dimethyl-1H-indene.

Molecular Properties

Compound Name2-cyclopropyl-5,6-dimethyl-1H-indene
PubChem CID167541438
Molecular FormulaC14H16
Molecular Weight184.28 g/mol
Exact Mass184.13
IUPAC Name2-cyclopropyl-5,6-dimethyl-1H-indene
SMILESCc1cc2c(cc1C)CC(C1CC1)=C2
InChIInChI=1S/C14H16/c1-9-5-12-7-14(11-3-4-11)8-13(12)6-10(9)2/h5-7,11H,3-4,8H2,1-2H3
InChIKeyJTADBUYAWKHTHU-UHFFFAOYSA-N
XLogP3.65
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 53.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-5,6-dimethyl-1H-indene?
The IUPAC name of 2-cyclopropyl-5,6-dimethyl-1H-indene (CID 167541438) is 2-cyclopropyl-5,6-dimethyl-1H-indene.
What is the SMILES notation for 2-cyclopropyl-5,6-dimethyl-1H-indene?
The canonical SMILES for 2-cyclopropyl-5,6-dimethyl-1H-indene is Cc1cc2c(cc1C)CC(C1CC1)=C2.
What is the InChIKey of 2-cyclopropyl-5,6-dimethyl-1H-indene?
The InChIKey is JTADBUYAWKHTHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16/c1-9-5-12-7-14(11-3-4-11)8-13(12)6-10(9)2/h5-7,11H,3-4,8H2,1-2H3.
What are the key properties of 2-cyclopropyl-5,6-dimethyl-1H-indene?
2-cyclopropyl-5,6-dimethyl-1H-indene has a molecular weight of 184.28 g/mol, XLogP of 3.65, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-5,6-dimethyl-1H-indene is sourced from PubChem (CID 167541438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).