5-propan-2-yltricyclo[8.5.0.02,8]pentadeca-1(10),2,4,6,8-pentaene

C18H22 — CID 19815689

IUPAC5-propan-2-yltricyclo[8.5.0.02,8]pentadeca-1(10),2,4,6,8-pentaene
SMILESCC(C)c1ccc2cc3c(c-2cc1)CCCCC3
InChIInChI=1S/C18H22/c1-13(2)14-8-9-16-12-15-6-4-3-5-7-17(15)18(16)11-10-14/h8-13H,3-7H2,1-2H3
InChIKeyCHPACFPPRPACKJ-UHFFFAOYSA-N
MW238.37 g/mol
LogP5.18
Rot. Bonds1

About 5-propan-2-yltricyclo[8.5.0.02,8]pentadeca-1(10),2,4,6,8-pentaene

5-propan-2-yltricyclo[8.5.0.02,8]pentadeca-1(10),2,4,6,8-pentaene (PubChem CID 19815689) has the molecular formula C18H22 and a molecular weight of 238.37 g/mol. Its IUPAC name is 5-propan-2-yltricyclo[8.5.0.02,8]pentadeca-1(10),2,4,6,8-pentaene.

Molecular Properties

Compound Name5-propan-2-yltricyclo[8.5.0.02,8]pentadeca-1(10),2,4,6,8-pentaene
PubChem CID19815689
Molecular FormulaC18H22
Molecular Weight238.37 g/mol
Exact Mass238.17
IUPAC Name5-propan-2-yltricyclo[8.5.0.02,8]pentadeca-1(10),2,4,6,8-pentaene
SMILESCC(C)c1ccc2cc3c(c-2cc1)CCCCC3
InChIInChI=1S/C18H22/c1-13(2)14-8-9-16-12-15-6-4-3-5-7-17(15)18(16)11-10-14/h8-13H,3-7H2,1-2H3
InChIKeyCHPACFPPRPACKJ-UHFFFAOYSA-N
XLogP5.18
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500238.37
LogP ≤ 55.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 5-propan-2-yltricyclo[8.5.0.02,8]pentadeca-1(10),2,4,6,8-pentaene with MolForge

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

Launch Full Analysis

Related Compounds

6-propan-2-yl-1,3-dihydroazuleno[1,2-c]thiophene
CID 57024052
6-(4-propan-2-ylphenyl)-1,2,3,4-tetrahydroquinoline
CID 55197505
ethane;methane;6-propan-2-yl-1,2,3,4-tetrahydronaphthalene
CID 160891896
4-[2-(4-propan-2-ylphenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]pyrrol-1-yl]benzoic acid
CID 53212873
6-(4-propan-2-ylphenyl)-3,4-dihydro-2H-isoquinolin-1-one
CID 142314640
6-[chloro-(4-propan-2-ylphenyl)methyl]-1,2,3,4-tetrahydronaphthalene
CID 63431080
2,4-di(propan-2-yl)-1-(4-propan-2-ylphenyl)benzene
CID 22103899
4-chloro-2-methyl-1-(4-propan-2-ylphenyl)benzene
CID 71243768
N-[[4-(2,3-dihydro-1H-inden-5-yl)-3-methylphenyl]methyl]propan-2-amine
CID 66481639
3-methyl-4-(5,6,7,8-tetrahydronaphthalen-2-yl)phenol
CID 167878538
2,5-bis(4-propan-2-ylphenyl)benzene-1,4-diol
CID 121300355
3-methyl-1-propan-2-yl-5,6,7,8-tetrahydroisochromen-2-ium
CID 134911583

Frequently Asked Questions

What is the IUPAC name of 5-propan-2-yltricyclo[8.5.0.02,8]pentadeca-1(10),2,4,6,8-pentaene?
The IUPAC name of 5-propan-2-yltricyclo[8.5.0.02,8]pentadeca-1(10),2,4,6,8-pentaene (CID 19815689) is 5-propan-2-yltricyclo[8.5.0.02,8]pentadeca-1(10),2,4,6,8-pentaene.
What is the SMILES notation for 5-propan-2-yltricyclo[8.5.0.02,8]pentadeca-1(10),2,4,6,8-pentaene?
The canonical SMILES for 5-propan-2-yltricyclo[8.5.0.02,8]pentadeca-1(10),2,4,6,8-pentaene is CC(C)c1ccc2cc3c(c-2cc1)CCCCC3.
What is the InChIKey of 5-propan-2-yltricyclo[8.5.0.02,8]pentadeca-1(10),2,4,6,8-pentaene?
The InChIKey is CHPACFPPRPACKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22/c1-13(2)14-8-9-16-12-15-6-4-3-5-7-17(15)18(16)11-10-14/h8-13H,3-7H2,1-2H3.
What are the key properties of 5-propan-2-yltricyclo[8.5.0.02,8]pentadeca-1(10),2,4,6,8-pentaene?
5-propan-2-yltricyclo[8.5.0.02,8]pentadeca-1(10),2,4,6,8-pentaene has a molecular weight of 238.37 g/mol, XLogP of 5.18, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5-propan-2-yltricyclo[8.5.0.02,8]pentadeca-1(10),2,4,6,8-pentaene is sourced from PubChem (CID 19815689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).