5-[(E)-2-cyclopropylprop-1-enyl]-6-ethenyl-4-methyl-2-prop-1-en-2-yl-2,3-dihydro-1H-indene;ethane

C23H32 — CID 156799700

IUPAC5-[(E)-2-cyclopropylprop-1-enyl]-6-ethenyl-4-methyl-2-prop-1-en-2-yl-2,3-dihydro-1H-indene;ethane
SMILESC=Cc1cc2c(c(C)c1/C=C(\C)C1CC1)CC(C(=C)C)C2.CC
InChIInChI=1S/C21H26.C2H6/c1-6-16-10-19-11-18(13(2)3)12-21(19)15(5)20(16)9-14(4)17-7-8-17;1-2/h6,9-10,17-18H,1-2,7-8,11-12H2,3-5H3;1-2H3/b14-9+;
InChIKeyDGYDUINZYVPCPL-KYIGKLDSSA-N
MW308.51 g/mol
LogP6.77
Rot. Bonds4

About 5-[(E)-2-cyclopropylprop-1-enyl]-6-ethenyl-4-methyl-2-prop-1-en-2-yl-2,3-dihydro-1H-indene;ethane

5-[(E)-2-cyclopropylprop-1-enyl]-6-ethenyl-4-methyl-2-prop-1-en-2-yl-2,3-dihydro-1H-indene;ethane (PubChem CID 156799700) has the molecular formula C23H32 and a molecular weight of 308.51 g/mol. Its IUPAC name is 5-[(E)-2-cyclopropylprop-1-enyl]-6-ethenyl-4-methyl-2-prop-1-en-2-yl-2,3-dihydro-1H-indene;ethane.

Molecular Properties

Compound Name5-[(E)-2-cyclopropylprop-1-enyl]-6-ethenyl-4-methyl-2-prop-1-en-2-yl-2,3-dihydro-1H-indene;ethane
PubChem CID156799700
Molecular FormulaC23H32
Molecular Weight308.51 g/mol
Exact Mass308.25
IUPAC Name5-[(E)-2-cyclopropylprop-1-enyl]-6-ethenyl-4-methyl-2-prop-1-en-2-yl-2,3-dihydro-1H-indene;ethane
SMILESC=Cc1cc2c(c(C)c1/C=C(\C)C1CC1)CC(C(=C)C)C2.CC
InChIInChI=1S/C21H26.C2H6/c1-6-16-10-19-11-18(13(2)3)12-21(19)15(5)20(16)9-14(4)17-7-8-17;1-2/h6,9-10,17-18H,1-2,7-8,11-12H2,3-5H3;1-2H3/b14-9+;
InChIKeyDGYDUINZYVPCPL-KYIGKLDSSA-N
XLogP6.77
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500308.51
LogP ≤ 56.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 5-[(E)-2-cyclopropylprop-1-enyl]-6-ethenyl-4-methyl-2-prop-1-en-2-yl-2,3-dihydro-1H-indene;ethane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-[(E)-2-cyclopropylprop-1-enyl]-6-ethenyl-4-methyl-2-prop-1-en-2-yl-2,3-dihydro-1H-indene;ethane?
The IUPAC name of 5-[(E)-2-cyclopropylprop-1-enyl]-6-ethenyl-4-methyl-2-prop-1-en-2-yl-2,3-dihydro-1H-indene;ethane (CID 156799700) is 5-[(E)-2-cyclopropylprop-1-enyl]-6-ethenyl-4-methyl-2-prop-1-en-2-yl-2,3-dihydro-1H-indene;ethane.
What is the SMILES notation for 5-[(E)-2-cyclopropylprop-1-enyl]-6-ethenyl-4-methyl-2-prop-1-en-2-yl-2,3-dihydro-1H-indene;ethane?
The canonical SMILES for 5-[(E)-2-cyclopropylprop-1-enyl]-6-ethenyl-4-methyl-2-prop-1-en-2-yl-2,3-dihydro-1H-indene;ethane is C=Cc1cc2c(c(C)c1/C=C(\C)C1CC1)CC(C(=C)C)C2.CC.
What is the InChIKey of 5-[(E)-2-cyclopropylprop-1-enyl]-6-ethenyl-4-methyl-2-prop-1-en-2-yl-2,3-dihydro-1H-indene;ethane?
The InChIKey is DGYDUINZYVPCPL-KYIGKLDSSA-N. The full InChI is InChI=1S/C21H26.C2H6/c1-6-16-10-19-11-18(13(2)3)12-21(19)15(5)20(16)9-14(4)17-7-8-17;1-2/h6,9-10,17-18H,1-2,7-8,11-12H2,3-5H3;1-2H3/b14-9+;.
What are the key properties of 5-[(E)-2-cyclopropylprop-1-enyl]-6-ethenyl-4-methyl-2-prop-1-en-2-yl-2,3-dihydro-1H-indene;ethane?
5-[(E)-2-cyclopropylprop-1-enyl]-6-ethenyl-4-methyl-2-prop-1-en-2-yl-2,3-dihydro-1H-indene;ethane has a molecular weight of 308.51 g/mol, XLogP of 6.77, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(E)-2-cyclopropylprop-1-enyl]-6-ethenyl-4-methyl-2-prop-1-en-2-yl-2,3-dihydro-1H-indene;ethane is sourced from PubChem (CID 156799700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).