1-(2,3-dihydro-1H-inden-5-yl)-4,4-dimethylpentan-1-ol

C16H24O — CID 115791341

IUPAC1-(2,3-dihydro-1H-inden-5-yl)-4,4-dimethylpentan-1-ol
SMILESCC(C)(C)CCC(O)c1ccc2c(c1)CCC2
InChIInChI=1S/C16H24O/c1-16(2,3)10-9-15(17)14-8-7-12-5-4-6-13(12)11-14/h7-8,11,15,17H,4-6,9-10H2,1-3H3
InChIKeyDBVSXIZLMCBKHL-UHFFFAOYSA-N
MW232.37 g/mol
LogP4.03
Rot. Bonds3

About 1-(2,3-dihydro-1H-inden-5-yl)-4,4-dimethylpentan-1-ol

1-(2,3-dihydro-1H-inden-5-yl)-4,4-dimethylpentan-1-ol (PubChem CID 115791341) has the molecular formula C16H24O and a molecular weight of 232.37 g/mol. Its IUPAC name is 1-(2,3-dihydro-1H-inden-5-yl)-4,4-dimethylpentan-1-ol.

Molecular Properties

Compound Name1-(2,3-dihydro-1H-inden-5-yl)-4,4-dimethylpentan-1-ol
PubChem CID115791341
Molecular FormulaC16H24O
Molecular Weight232.37 g/mol
Exact Mass232.18
IUPAC Name1-(2,3-dihydro-1H-inden-5-yl)-4,4-dimethylpentan-1-ol
SMILESCC(C)(C)CCC(O)c1ccc2c(c1)CCC2
InChIInChI=1S/C16H24O/c1-16(2,3)10-9-15(17)14-8-7-12-5-4-6-13(12)11-14/h7-8,11,15,17H,4-6,9-10H2,1-3H3
InChIKeyDBVSXIZLMCBKHL-UHFFFAOYSA-N
XLogP4.03
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-sulfanyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)propan-1-ol
CID 116830936
3-methylsulfanyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)propan-1-ol
CID 116831085
(1S)-2-amino-1-(2,3-dihydro-1H-inden-5-yl)ethanol
CID 83001263
4-(2,3-dihydro-1H-inden-5-yl)-4-hydroxy-2,2-dimethylbutanoic acid
CID 65297695
1-(2,3-dihydro-1H-inden-5-yl)-5,5-dimethylhex-3-yn-1-ol
CID 114190708
3-amino-1-(6,7,8,9-tetrahydro-5H-benzo[7]annulen-3-yl)propan-1-ol
CID 84684971
sodium 4-(2,3-dihydro-1H-inden-5-yl)-4-hydroxybutanoate
CID 23703653
N-[2-(2,3-dihydro-1H-inden-5-yl)-2-hydroxyethyl]-2,2-dimethylpropanamide
CID 82121740
1-(2,3-dihydro-1H-inden-5-yl)-2-methylpropan-1-ol
CID 61087028
1-(2,3-dihydro-1H-inden-5-yl)-3-(furan-2-yl)propan-1-ol
CID 114195082
3-piperazin-1-yl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)propan-1-ol
CID 82073590
1-(4-bromophenyl)-4,4-dimethylpentan-1-ol
CID 62608151

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydro-1H-inden-5-yl)-4,4-dimethylpentan-1-ol?
The IUPAC name of 1-(2,3-dihydro-1H-inden-5-yl)-4,4-dimethylpentan-1-ol (CID 115791341) is 1-(2,3-dihydro-1H-inden-5-yl)-4,4-dimethylpentan-1-ol.
What is the SMILES notation for 1-(2,3-dihydro-1H-inden-5-yl)-4,4-dimethylpentan-1-ol?
The canonical SMILES for 1-(2,3-dihydro-1H-inden-5-yl)-4,4-dimethylpentan-1-ol is CC(C)(C)CCC(O)c1ccc2c(c1)CCC2.
What is the InChIKey of 1-(2,3-dihydro-1H-inden-5-yl)-4,4-dimethylpentan-1-ol?
The InChIKey is DBVSXIZLMCBKHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24O/c1-16(2,3)10-9-15(17)14-8-7-12-5-4-6-13(12)11-14/h7-8,11,15,17H,4-6,9-10H2,1-3H3.
What are the key properties of 1-(2,3-dihydro-1H-inden-5-yl)-4,4-dimethylpentan-1-ol?
1-(2,3-dihydro-1H-inden-5-yl)-4,4-dimethylpentan-1-ol has a molecular weight of 232.37 g/mol, XLogP of 4.03, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydro-1H-inden-5-yl)-4,4-dimethylpentan-1-ol is sourced from PubChem (CID 115791341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).