1-(2-hydroxycyclohexyl)-2,6,6-trimethyl-5,7-dihydro-4H-indol-4-ol

C17H27NO2 — CID 62359810

IUPAC1-(2-hydroxycyclohexyl)-2,6,6-trimethyl-5,7-dihydro-4H-indol-4-ol
SMILESCc1cc2c(n1C1CCCCC1O)CC(C)(C)CC2O
InChIInChI=1S/C17H27NO2/c1-11-8-12-14(9-17(2,3)10-16(12)20)18(11)13-6-4-5-7-15(13)19/h8,13,15-16,19-20H,4-7,9-10H2,1-3H3
InChIKeyZPWSKMUYAZCEDX-UHFFFAOYSA-N
MW277.41 g/mol
LogP3.28
Rot. Bonds1

About 1-(2-hydroxycyclohexyl)-2,6,6-trimethyl-5,7-dihydro-4H-indol-4-ol

1-(2-hydroxycyclohexyl)-2,6,6-trimethyl-5,7-dihydro-4H-indol-4-ol (PubChem CID 62359810) has the molecular formula C17H27NO2 and a molecular weight of 277.41 g/mol. Its IUPAC name is 1-(2-hydroxycyclohexyl)-2,6,6-trimethyl-5,7-dihydro-4H-indol-4-ol.

Molecular Properties

Compound Name1-(2-hydroxycyclohexyl)-2,6,6-trimethyl-5,7-dihydro-4H-indol-4-ol
PubChem CID62359810
Molecular FormulaC17H27NO2
Molecular Weight277.41 g/mol
Exact Mass277.20
IUPAC Name1-(2-hydroxycyclohexyl)-2,6,6-trimethyl-5,7-dihydro-4H-indol-4-ol
SMILESCc1cc2c(n1C1CCCCC1O)CC(C)(C)CC2O
InChIInChI=1S/C17H27NO2/c1-11-8-12-14(9-17(2,3)10-16(12)20)18(11)13-6-4-5-7-15(13)19/h8,13,15-16,19-20H,4-7,9-10H2,1-3H3
InChIKeyZPWSKMUYAZCEDX-UHFFFAOYSA-N
XLogP3.28
TPSA45.39 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.41
LogP ≤ 53.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclooctyl-2,6,6-trimethyl-5,7-dihydro-4H-indol-4-ol
CID 63466063
1-(2,2-difluoroethyl)-2,6,6-trimethyl-5,7-dihydro-4H-indol-4-ol
CID 115408512
4-(4-hydroxy-2,6,6-trimethyl-5,7-dihydro-4H-indol-1-yl)pyrrolidin-2-one
CID 106188086
2,6,6-trimethyl-1-(2-pyrrolidin-1-ylethyl)-5,7-dihydro-4H-indol-4-ol
CID 62640256
2,6,6-trimethyl-1-pent-3-ynyl-5,7-dihydro-4H-indol-4-ol
CID 116645351
1-(2,5-dimethylphenyl)-2,6,6-trimethyl-5,7-dihydro-4H-indol-4-ol
CID 63464982
2,6,6-trimethyl-1-[2-(2,2,2-trifluoroethoxy)ethyl]-5,7-dihydro-4H-indol-4-ol
CID 63826731
1-(2-chlorophenyl)-2,6,6-trimethyl-5,7-dihydro-4H-indol-4-ol
CID 63465888
2,6,6-trimethyl-1-(5-methyl-3-pyridinyl)-5,7-dihydro-4H-indol-4-ol
CID 107586552
1-[(1,1-dioxothiolan-3-yl)methyl]-2,6,6-trimethyl-5,7-dihydro-4H-indol-4-ol
CID 62132538
2,6,6-trimethyl-1-[2-[methyl(propan-2-yl)amino]ethyl]-5,7-dihydro-4H-indol-4-ol
CID 62639906
2-(4-hydroxy-2,6,6-trimethyl-5,7-dihydro-4H-indol-1-yl)-3-methylbutanamide
CID 106347058

Frequently Asked Questions

What is the IUPAC name of 1-(2-hydroxycyclohexyl)-2,6,6-trimethyl-5,7-dihydro-4H-indol-4-ol?
The IUPAC name of 1-(2-hydroxycyclohexyl)-2,6,6-trimethyl-5,7-dihydro-4H-indol-4-ol (CID 62359810) is 1-(2-hydroxycyclohexyl)-2,6,6-trimethyl-5,7-dihydro-4H-indol-4-ol.
What is the SMILES notation for 1-(2-hydroxycyclohexyl)-2,6,6-trimethyl-5,7-dihydro-4H-indol-4-ol?
The canonical SMILES for 1-(2-hydroxycyclohexyl)-2,6,6-trimethyl-5,7-dihydro-4H-indol-4-ol is Cc1cc2c(n1C1CCCCC1O)CC(C)(C)CC2O.
What is the InChIKey of 1-(2-hydroxycyclohexyl)-2,6,6-trimethyl-5,7-dihydro-4H-indol-4-ol?
The InChIKey is ZPWSKMUYAZCEDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27NO2/c1-11-8-12-14(9-17(2,3)10-16(12)20)18(11)13-6-4-5-7-15(13)19/h8,13,15-16,19-20H,4-7,9-10H2,1-3H3.
What are the key properties of 1-(2-hydroxycyclohexyl)-2,6,6-trimethyl-5,7-dihydro-4H-indol-4-ol?
1-(2-hydroxycyclohexyl)-2,6,6-trimethyl-5,7-dihydro-4H-indol-4-ol has a molecular weight of 277.41 g/mol, XLogP of 3.28, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-hydroxycyclohexyl)-2,6,6-trimethyl-5,7-dihydro-4H-indol-4-ol is sourced from PubChem (CID 62359810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).