2-pent-1-en-3-yl-2,3-dihydro-1H-indene

C14H18 — CID 174911971

IUPAC2-pent-1-en-3-yl-2,3-dihydro-1H-indene
SMILESC=CC(CC)C1Cc2ccccc2C1
InChIInChI=1S/C14H18/c1-3-11(4-2)14-9-12-7-5-6-8-13(12)10-14/h3,5-8,11,14H,1,4,9-10H2,2H3
InChIKeyWKPURLQWYDGGHF-UHFFFAOYSA-N
MW186.30 g/mol
LogP3.61
Rot. Bonds3

About 2-pent-1-en-3-yl-2,3-dihydro-1H-indene

2-pent-1-en-3-yl-2,3-dihydro-1H-indene (PubChem CID 174911971) has the molecular formula C14H18 and a molecular weight of 186.30 g/mol. Its IUPAC name is 2-pent-1-en-3-yl-2,3-dihydro-1H-indene.

Molecular Properties

Compound Name2-pent-1-en-3-yl-2,3-dihydro-1H-indene
PubChem CID174911971
Molecular FormulaC14H18
Molecular Weight186.30 g/mol
Exact Mass186.14
IUPAC Name2-pent-1-en-3-yl-2,3-dihydro-1H-indene
SMILESC=CC(CC)C1Cc2ccccc2C1
InChIInChI=1S/C14H18/c1-3-11(4-2)14-9-12-7-5-6-8-13(12)10-14/h3,5-8,11,14H,1,4,9-10H2,2H3
InChIKeyWKPURLQWYDGGHF-UHFFFAOYSA-N
XLogP3.61
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-pent-1-en-3-yl-2,3-dihydro-1H-indene?
The IUPAC name of 2-pent-1-en-3-yl-2,3-dihydro-1H-indene (CID 174911971) is 2-pent-1-en-3-yl-2,3-dihydro-1H-indene.
What is the SMILES notation for 2-pent-1-en-3-yl-2,3-dihydro-1H-indene?
The canonical SMILES for 2-pent-1-en-3-yl-2,3-dihydro-1H-indene is C=CC(CC)C1Cc2ccccc2C1.
What is the InChIKey of 2-pent-1-en-3-yl-2,3-dihydro-1H-indene?
The InChIKey is WKPURLQWYDGGHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18/c1-3-11(4-2)14-9-12-7-5-6-8-13(12)10-14/h3,5-8,11,14H,1,4,9-10H2,2H3.
What are the key properties of 2-pent-1-en-3-yl-2,3-dihydro-1H-indene?
2-pent-1-en-3-yl-2,3-dihydro-1H-indene has a molecular weight of 186.30 g/mol, XLogP of 3.61, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pent-1-en-3-yl-2,3-dihydro-1H-indene is sourced from PubChem (CID 174911971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).