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

C15H22O — CID 62264698

IUPAC2-(2-methylpentyl)-2,3-dihydro-1H-inden-1-ol
SMILESCCCC(C)CC1Cc2ccccc2C1O
InChIInChI=1S/C15H22O/c1-3-6-11(2)9-13-10-12-7-4-5-8-14(12)15(13)16/h4-5,7-8,11,13,15-16H,3,6,9-10H2,1-2H3
InChIKeyZSSQIKOZGNNQGH-UHFFFAOYSA-N
MW218.34 g/mol
LogP3.72
Rot. Bonds4

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

2-(2-methylpentyl)-2,3-dihydro-1H-inden-1-ol (PubChem CID 62264698) has the molecular formula C15H22O and a molecular weight of 218.34 g/mol. Its IUPAC name is 2-(2-methylpentyl)-2,3-dihydro-1H-inden-1-ol.

Molecular Properties

Compound Name2-(2-methylpentyl)-2,3-dihydro-1H-inden-1-ol
PubChem CID62264698
Molecular FormulaC15H22O
Molecular Weight218.34 g/mol
Exact Mass218.17
IUPAC Name2-(2-methylpentyl)-2,3-dihydro-1H-inden-1-ol
SMILESCCCC(C)CC1Cc2ccccc2C1O
InChIInChI=1S/C15H22O/c1-3-6-11(2)9-13-10-12-7-4-5-8-14(12)15(13)16/h4-5,7-8,11,13,15-16H,3,6,9-10H2,1-2H3
InChIKeyZSSQIKOZGNNQGH-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-ethylbutyl)-2,3-dihydro-1H-inden-1-ol
CID 82930706
N-ethyl-6-(2-methylpentyl)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine
CID 63403421
(1S)-2,3-dihydro-1H-indene-1,2-diol
CID 68820122
1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)butan-1-ol
CID 64987075
(1S,2S)-1-ethyl-2,3-dihydro-1H-inden-2-ol
CID 130811012
(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
(1R,2S)-2-(3-methylbutylamino)-2,3-dihydro-1H-inden-1-ol
CID 99831571
(1R,2S)-2-ethyl-N-propan-2-yl-2,3-dihydro-1H-inden-1-amine
CID 134490907
(2R)-2-(pyrrolidin-1-ylmethyl)-2,3-dihydro-1H-inden-1-ol
CID 58393646
3-ethyl-1,2,3,4-tetrahydronaphthalen-2-ol
CID 89150261
(1S,2R)-2-(diethylamino)-2,3-dihydro-1H-inden-1-ol
CID 131856725

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylpentyl)-2,3-dihydro-1H-inden-1-ol?
The IUPAC name of 2-(2-methylpentyl)-2,3-dihydro-1H-inden-1-ol (CID 62264698) is 2-(2-methylpentyl)-2,3-dihydro-1H-inden-1-ol.
What is the SMILES notation for 2-(2-methylpentyl)-2,3-dihydro-1H-inden-1-ol?
The canonical SMILES for 2-(2-methylpentyl)-2,3-dihydro-1H-inden-1-ol is CCCC(C)CC1Cc2ccccc2C1O.
What is the InChIKey of 2-(2-methylpentyl)-2,3-dihydro-1H-inden-1-ol?
The InChIKey is ZSSQIKOZGNNQGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22O/c1-3-6-11(2)9-13-10-12-7-4-5-8-14(12)15(13)16/h4-5,7-8,11,13,15-16H,3,6,9-10H2,1-2H3.
What are the key properties of 2-(2-methylpentyl)-2,3-dihydro-1H-inden-1-ol?
2-(2-methylpentyl)-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-methylpentyl)-2,3-dihydro-1H-inden-1-ol is sourced from PubChem (CID 62264698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).