1-cyclooctyl-6,6-dimethyl-5,7-dihydro-4H-indol-4-ol

C18H29NO — CID 63466233

IUPAC1-cyclooctyl-6,6-dimethyl-5,7-dihydro-4H-indol-4-ol
SMILESCC1(C)Cc2c(ccn2C2CCCCCCC2)C(O)C1
InChIInChI=1S/C18H29NO/c1-18(2)12-16-15(17(20)13-18)10-11-19(16)14-8-6-4-3-5-7-9-14/h10-11,14,17,20H,3-9,12-13H2,1-2H3
InChIKeyDOVFDGPIPDPXAI-UHFFFAOYSA-N
MW275.44 g/mol
LogP4.78
Rot. Bonds1

About 1-cyclooctyl-6,6-dimethyl-5,7-dihydro-4H-indol-4-ol

1-cyclooctyl-6,6-dimethyl-5,7-dihydro-4H-indol-4-ol (PubChem CID 63466233) has the molecular formula C18H29NO and a molecular weight of 275.44 g/mol. Its IUPAC name is 1-cyclooctyl-6,6-dimethyl-5,7-dihydro-4H-indol-4-ol.

Molecular Properties

Compound Name1-cyclooctyl-6,6-dimethyl-5,7-dihydro-4H-indol-4-ol
PubChem CID63466233
Molecular FormulaC18H29NO
Molecular Weight275.44 g/mol
Exact Mass275.22
IUPAC Name1-cyclooctyl-6,6-dimethyl-5,7-dihydro-4H-indol-4-ol
SMILESCC1(C)Cc2c(ccn2C2CCCCCCC2)C(O)C1
InChIInChI=1S/C18H29NO/c1-18(2)12-16-15(17(20)13-18)10-11-19(16)14-8-6-4-3-5-7-9-14/h10-11,14,17,20H,3-9,12-13H2,1-2H3
InChIKeyDOVFDGPIPDPXAI-UHFFFAOYSA-N
XLogP4.78
TPSA25.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.44
LogP ≤ 54.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclooctyl-6,6-dimethyl-5,7-dihydro-4H-indol-4-ol?
The IUPAC name of 1-cyclooctyl-6,6-dimethyl-5,7-dihydro-4H-indol-4-ol (CID 63466233) is 1-cyclooctyl-6,6-dimethyl-5,7-dihydro-4H-indol-4-ol.
What is the SMILES notation for 1-cyclooctyl-6,6-dimethyl-5,7-dihydro-4H-indol-4-ol?
The canonical SMILES for 1-cyclooctyl-6,6-dimethyl-5,7-dihydro-4H-indol-4-ol is CC1(C)Cc2c(ccn2C2CCCCCCC2)C(O)C1.
What is the InChIKey of 1-cyclooctyl-6,6-dimethyl-5,7-dihydro-4H-indol-4-ol?
The InChIKey is DOVFDGPIPDPXAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29NO/c1-18(2)12-16-15(17(20)13-18)10-11-19(16)14-8-6-4-3-5-7-9-14/h10-11,14,17,20H,3-9,12-13H2,1-2H3.
What are the key properties of 1-cyclooctyl-6,6-dimethyl-5,7-dihydro-4H-indol-4-ol?
1-cyclooctyl-6,6-dimethyl-5,7-dihydro-4H-indol-4-ol has a molecular weight of 275.44 g/mol, XLogP of 4.78, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclooctyl-6,6-dimethyl-5,7-dihydro-4H-indol-4-ol is sourced from PubChem (CID 63466233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).