4,4-bis(prop-2-enyl)-2H-cyclopenta[a]indene;methane

C19H22 — CID 143545860

IUPAC4,4-bis(prop-2-enyl)-2H-cyclopenta[a]indene;methane
SMILESC.C=CCC1(CC=C)C2=CCC=C2c2ccccc21
InChIInChI=1S/C18H18.CH4/c1-3-12-18(13-4-2)16-10-6-5-8-14(16)15-9-7-11-17(15)18;/h3-6,8-11H,1-2,7,12-13H2;1H4
InChIKeyMILPJPCVYCRKKS-UHFFFAOYSA-N
MW250.38 g/mol
LogP5.44
Rot. Bonds4

About 4,4-bis(prop-2-enyl)-2H-cyclopenta[a]indene;methane

4,4-bis(prop-2-enyl)-2H-cyclopenta[a]indene;methane (PubChem CID 143545860) has the molecular formula C19H22 and a molecular weight of 250.38 g/mol. Its IUPAC name is 4,4-bis(prop-2-enyl)-2H-cyclopenta[a]indene;methane.

Molecular Properties

Compound Name4,4-bis(prop-2-enyl)-2H-cyclopenta[a]indene;methane
PubChem CID143545860
Molecular FormulaC19H22
Molecular Weight250.38 g/mol
Exact Mass250.17
IUPAC Name4,4-bis(prop-2-enyl)-2H-cyclopenta[a]indene;methane
SMILESC.C=CCC1(CC=C)C2=CCC=C2c2ccccc21
InChIInChI=1S/C18H18.CH4/c1-3-12-18(13-4-2)16-10-6-5-8-14(16)15-9-7-11-17(15)18;/h3-6,8-11H,1-2,7,12-13H2;1H4
InChIKeyMILPJPCVYCRKKS-UHFFFAOYSA-N
XLogP5.44
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500250.38
LogP ≤ 55.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

9,9,18,18,27,27-hexakis(prop-2-enyl)heptacyclo[18.7.0.02,10.03,8.011,19.012,17.021,26]heptacosa-1,3,5,7,10,12,14,16,19,21,23,25-dodecaene
CID 11628484
2-(9-prop-2-enylfluoren-9-yl)ethanol
CID 11391058
1-chloro-9,9-bis(prop-2-enyl)fluorene
CID 174649432
3-[10,10-bis(prop-2-enyl)anthracen-9-ylidene]-N,N-dimethylpropan-1-amine
CID 1203583
9-prop-2-enyl-9-tridec-2-enylfluorene
CID 91376717
9-prop-2-enyl-9-undec-2-enylfluorene
CID 91593860
3-methylidene-1-prop-2-enyl-2H-inden-1-ol
CID 86041926
6,12-dimethyl-6,12-bis(prop-2-enyl)indeno[1,2-b]fluorene
CID 155763593
1-[9,9-bis(prop-2-enyl)fluoren-2-yl]propan-2-one
CID 174822962
3,3,4,4-tetrakis(prop-2-enyl)-1,2-dihydronaphthalene
CID 173371645
trimethyl-(9-prop-2-enylfluoren-9-yl)oxysilane
CID 71366117
9,9-dimethyl-2,3-dihydrofluorene
CID 123727902

Frequently Asked Questions

What is the IUPAC name of 4,4-bis(prop-2-enyl)-2H-cyclopenta[a]indene;methane?
The IUPAC name of 4,4-bis(prop-2-enyl)-2H-cyclopenta[a]indene;methane (CID 143545860) is 4,4-bis(prop-2-enyl)-2H-cyclopenta[a]indene;methane.
What is the SMILES notation for 4,4-bis(prop-2-enyl)-2H-cyclopenta[a]indene;methane?
The canonical SMILES for 4,4-bis(prop-2-enyl)-2H-cyclopenta[a]indene;methane is C.C=CCC1(CC=C)C2=CCC=C2c2ccccc21.
What is the InChIKey of 4,4-bis(prop-2-enyl)-2H-cyclopenta[a]indene;methane?
The InChIKey is MILPJPCVYCRKKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18.CH4/c1-3-12-18(13-4-2)16-10-6-5-8-14(16)15-9-7-11-17(15)18;/h3-6,8-11H,1-2,7,12-13H2;1H4.
What are the key properties of 4,4-bis(prop-2-enyl)-2H-cyclopenta[a]indene;methane?
4,4-bis(prop-2-enyl)-2H-cyclopenta[a]indene;methane has a molecular weight of 250.38 g/mol, XLogP of 5.44, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-bis(prop-2-enyl)-2H-cyclopenta[a]indene;methane is sourced from PubChem (CID 143545860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).