2-(1-cyclohexyl-2,3-dihydroindol-5-yl)propan-1-ol

C17H25NO — CID 117118471

IUPAC2-(1-cyclohexyl-2,3-dihydroindol-5-yl)propan-1-ol
SMILESCC(CO)c1ccc2c(c1)CCN2C1CCCCC1
InChIInChI=1S/C17H25NO/c1-13(12-19)14-7-8-17-15(11-14)9-10-18(17)16-5-3-2-4-6-16/h7-8,11,13,16,19H,2-6,9-10,12H2,1H3
InChIKeyIDFRDKIMFNKARS-UHFFFAOYSA-N
MW259.39 g/mol
LogP3.48
Rot. Bonds3

About 2-(1-cyclohexyl-2,3-dihydroindol-5-yl)propan-1-ol

2-(1-cyclohexyl-2,3-dihydroindol-5-yl)propan-1-ol (PubChem CID 117118471) has the molecular formula C17H25NO and a molecular weight of 259.39 g/mol. Its IUPAC name is 2-(1-cyclohexyl-2,3-dihydroindol-5-yl)propan-1-ol.

Molecular Properties

Compound Name2-(1-cyclohexyl-2,3-dihydroindol-5-yl)propan-1-ol
PubChem CID117118471
Molecular FormulaC17H25NO
Molecular Weight259.39 g/mol
Exact Mass259.19
IUPAC Name2-(1-cyclohexyl-2,3-dihydroindol-5-yl)propan-1-ol
SMILESCC(CO)c1ccc2c(c1)CCN2C1CCCCC1
InChIInChI=1S/C17H25NO/c1-13(12-19)14-7-8-17-15(11-14)9-10-18(17)16-5-3-2-4-6-16/h7-8,11,13,16,19H,2-6,9-10,12H2,1H3
InChIKeyIDFRDKIMFNKARS-UHFFFAOYSA-N
XLogP3.48
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.39
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(1-cyclopentyl-2,3-dihydroindol-6-yl)propan-1-ol
CID 115115373
1-(1-cyclohexyl-2,3-dihydroindol-5-yl)ethanol
CID 117118466
2-[1-(cyclopropylmethyl)-2,3-dihydroindol-5-yl]propan-1-ol
CID 117118731
2-(1-cyclopentyl-2,3-dihydroindol-5-yl)propan-2-ol
CID 115115348
(1-cyclopentyl-2,3-dihydroindol-5-yl)methanamine
CID 115115353
1-cyclohexyl-5-ethenyl-2,3-dihydroindole
CID 66772198
2-(1-cyclobutyl-2,3-dihydroindol-7-yl)propan-1-ol
CID 115115125
2-(1-cyclopentyl-2,3-dihydroindol-5-yl)ethanamine
CID 115115356
6-(1-hydroxypropan-2-yl)-1-methyl-3,4-dihydroquinolin-2-one
CID 117312785
(1-cyclobutyl-2,3-dihydroindol-5-yl)methanamine
CID 115115080
tert-butyl 5-(1-hydroxypropan-2-yl)-2,3-dihydroindole-1-carboxylate
CID 117444696
tert-butyl 6-(1-hydroxypropan-2-yl)-3,4-dihydro-2H-quinoline-1-carboxylate
CID 117470874

Frequently Asked Questions

What is the IUPAC name of 2-(1-cyclohexyl-2,3-dihydroindol-5-yl)propan-1-ol?
The IUPAC name of 2-(1-cyclohexyl-2,3-dihydroindol-5-yl)propan-1-ol (CID 117118471) is 2-(1-cyclohexyl-2,3-dihydroindol-5-yl)propan-1-ol.
What is the SMILES notation for 2-(1-cyclohexyl-2,3-dihydroindol-5-yl)propan-1-ol?
The canonical SMILES for 2-(1-cyclohexyl-2,3-dihydroindol-5-yl)propan-1-ol is CC(CO)c1ccc2c(c1)CCN2C1CCCCC1.
What is the InChIKey of 2-(1-cyclohexyl-2,3-dihydroindol-5-yl)propan-1-ol?
The InChIKey is IDFRDKIMFNKARS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO/c1-13(12-19)14-7-8-17-15(11-14)9-10-18(17)16-5-3-2-4-6-16/h7-8,11,13,16,19H,2-6,9-10,12H2,1H3.
What are the key properties of 2-(1-cyclohexyl-2,3-dihydroindol-5-yl)propan-1-ol?
2-(1-cyclohexyl-2,3-dihydroindol-5-yl)propan-1-ol has a molecular weight of 259.39 g/mol, XLogP of 3.48, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-cyclohexyl-2,3-dihydroindol-5-yl)propan-1-ol is sourced from PubChem (CID 117118471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).