2-(2-ethylbutyl)-2,3-dihydro-1H-inden-1-ol

C15H22O — CID 82930706

IUPAC2-(2-ethylbutyl)-2,3-dihydro-1H-inden-1-ol
SMILESCCC(CC)CC1Cc2ccccc2C1O
InChIInChI=1S/C15H22O/c1-3-11(4-2)9-13-10-12-7-5-6-8-14(12)15(13)16/h5-8,11,13,15-16H,3-4,9-10H2,1-2H3
InChIKeyWHZDOFGJGRHNIE-UHFFFAOYSA-N
MW218.34 g/mol
LogP3.72
Rot. Bonds4

About 2-(2-ethylbutyl)-2,3-dihydro-1H-inden-1-ol

2-(2-ethylbutyl)-2,3-dihydro-1H-inden-1-ol (PubChem CID 82930706) has the molecular formula C15H22O and a molecular weight of 218.34 g/mol. Its IUPAC name is 2-(2-ethylbutyl)-2,3-dihydro-1H-inden-1-ol.

Molecular Properties

Compound Name2-(2-ethylbutyl)-2,3-dihydro-1H-inden-1-ol
PubChem CID82930706
Molecular FormulaC15H22O
Molecular Weight218.34 g/mol
Exact Mass218.17
IUPAC Name2-(2-ethylbutyl)-2,3-dihydro-1H-inden-1-ol
SMILESCCC(CC)CC1Cc2ccccc2C1O
InChIInChI=1S/C15H22O/c1-3-11(4-2)9-13-10-12-7-5-6-8-14(12)15(13)16/h5-8,11,13,15-16H,3-4,9-10H2,1-2H3
InChIKeyWHZDOFGJGRHNIE-UHFFFAOYSA-N
XLogP3.72
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2-methylpentyl)-2,3-dihydro-1H-inden-1-ol
CID 62264698
(1S)-2,3-dihydro-1H-indene-1,2-diol
CID 68820122
(1R,2R,3R)-2-bromo-3-(bromomethyl)-1,2,3,4-tetrahydronaphthalen-1-ol
CID 102321992
2-(2,3-dihydro-1-benzofuran-2-ylmethyl)-2,3-dihydro-1H-inden-1-ol
CID 66363431
(2R)-2-(pyrrolidin-1-ylmethyl)-2,3-dihydro-1H-inden-1-ol
CID 58393646
N-(2-ethylbutyl)bicyclo[4.2.0]octa-1,3,5-triene-7-carboxamide
CID 115648847
ethane;2-ethyl-1,2,3,4-tetrahydronaphthalen-1-ol
CID 145337942
(1S,2R)-2-(diethylamino)-2,3-dihydro-1H-inden-1-ol
CID 131856725
(1S,2S)-2-amino-2,3-dihydro-1H-inden-1-ol;hydrochloride
CID 71776086
2-(4,4,4-trifluorobutyl)-2,3-dihydro-1H-inden-1-ol
CID 113327265
2-(7-bicyclo[4.2.0]octa-1,3,5-trienylmethyl)butanoic acid
CID 79425221
2-(2-phenylsulfanylethyl)-2,3-dihydro-1H-inden-1-ol
CID 79227500

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylbutyl)-2,3-dihydro-1H-inden-1-ol?
The IUPAC name of 2-(2-ethylbutyl)-2,3-dihydro-1H-inden-1-ol (CID 82930706) is 2-(2-ethylbutyl)-2,3-dihydro-1H-inden-1-ol.
What is the SMILES notation for 2-(2-ethylbutyl)-2,3-dihydro-1H-inden-1-ol?
The canonical SMILES for 2-(2-ethylbutyl)-2,3-dihydro-1H-inden-1-ol is CCC(CC)CC1Cc2ccccc2C1O.
What is the InChIKey of 2-(2-ethylbutyl)-2,3-dihydro-1H-inden-1-ol?
The InChIKey is WHZDOFGJGRHNIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22O/c1-3-11(4-2)9-13-10-12-7-5-6-8-14(12)15(13)16/h5-8,11,13,15-16H,3-4,9-10H2,1-2H3.
What are the key properties of 2-(2-ethylbutyl)-2,3-dihydro-1H-inden-1-ol?
2-(2-ethylbutyl)-2,3-dihydro-1H-inden-1-ol has a molecular weight of 218.34 g/mol, XLogP of 3.72, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylbutyl)-2,3-dihydro-1H-inden-1-ol is sourced from PubChem (CID 82930706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).