1-pent-4-en-2-yloxy-2,3-dihydro-1H-indene

C14H17O- — CID 163573761

IUPAC1-pent-4-en-2-yloxy-2,3-dihydro-1H-indene
SMILESC=C[CH-]C(C)OC1CCc2ccccc21
InChIInChI=1S/C14H17O/c1-3-6-11(2)15-14-10-9-12-7-4-5-8-13(12)14/h3-8,11,14H,1,9-10H2,2H3/q-1
InChIKeyGBQJPDKCNXKHIC-UHFFFAOYSA-N
MW201.29 g/mol
LogP3.47
Rot. Bonds4

About 1-pent-4-en-2-yloxy-2,3-dihydro-1H-indene

1-pent-4-en-2-yloxy-2,3-dihydro-1H-indene (PubChem CID 163573761) has the molecular formula C14H17O- and a molecular weight of 201.29 g/mol. Its IUPAC name is 1-pent-4-en-2-yloxy-2,3-dihydro-1H-indene.

Molecular Properties

Compound Name1-pent-4-en-2-yloxy-2,3-dihydro-1H-indene
PubChem CID163573761
Molecular FormulaC14H17O-
Molecular Weight201.29 g/mol
Exact Mass201.13
IUPAC Name1-pent-4-en-2-yloxy-2,3-dihydro-1H-indene
SMILESC=C[CH-]C(C)OC1CCc2ccccc21
InChIInChI=1S/C14H17O/c1-3-6-11(2)15-14-10-9-12-7-4-5-8-13(12)14/h3-8,11,14H,1,9-10H2,2H3/q-1
InChIKeyGBQJPDKCNXKHIC-UHFFFAOYSA-N
XLogP3.47
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.29
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-(2,3-dihydro-1H-inden-1-yloxymethoxy)-2,3-dihydro-1H-indene
CID 70037925
(2R,3R)-2-(2,3-dihydro-1H-inden-1-yloxy)-3-hydroxybutanedioic acid
CID 102059267
(1R)-1-propan-2-yl-2,3-dihydro-1H-indene
CID 59961726
2,3-dihydro-1H-inden-1-yl 2-methylbutanoate
CID 59254180
(1S,2S)-2-methyl-1-propan-2-yl-1,2,3,4-tetrahydronaphthalene
CID 157427807
1-(2-methylphenoxy)-2,3-dihydro-1H-indene
CID 57123599
2-(2,3-dihydro-1H-inden-1-yloxy)-3-methoxybenzonitrile
CID 117052936
2-ethenyltricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaene
CID 168728590
2,3-dihydro-1H-inden-1-yl 2,2-dimethylpropanoate
CID 10262840
2-(2,3-dihydro-1H-inden-1-yloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonic acid
CID 129070332
1-(2,3-dihydro-1H-inden-1-yl)ethanamine
CID 23332534
(1R,2S)-2-methoxy-1-propan-2-yl-1,2,3,4-tetrahydronaphthalene
CID 118421434

Frequently Asked Questions

What is the IUPAC name of 1-pent-4-en-2-yloxy-2,3-dihydro-1H-indene?
The IUPAC name of 1-pent-4-en-2-yloxy-2,3-dihydro-1H-indene (CID 163573761) is 1-pent-4-en-2-yloxy-2,3-dihydro-1H-indene.
What is the SMILES notation for 1-pent-4-en-2-yloxy-2,3-dihydro-1H-indene?
The canonical SMILES for 1-pent-4-en-2-yloxy-2,3-dihydro-1H-indene is C=C[CH-]C(C)OC1CCc2ccccc21.
What is the InChIKey of 1-pent-4-en-2-yloxy-2,3-dihydro-1H-indene?
The InChIKey is GBQJPDKCNXKHIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17O/c1-3-6-11(2)15-14-10-9-12-7-4-5-8-13(12)14/h3-8,11,14H,1,9-10H2,2H3/q-1.
What are the key properties of 1-pent-4-en-2-yloxy-2,3-dihydro-1H-indene?
1-pent-4-en-2-yloxy-2,3-dihydro-1H-indene has a molecular weight of 201.29 g/mol, XLogP of 3.47, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pent-4-en-2-yloxy-2,3-dihydro-1H-indene is sourced from PubChem (CID 163573761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).