(1S,2S)-2-methyl-4-propan-2-yl-1,2-dihydronaphthalen-1-ol

C14H18O — CID 134966420

IUPAC(1S,2S)-2-methyl-4-propan-2-yl-1,2-dihydronaphthalen-1-ol
SMILESCC(C)C1=C[C@H](C)[C@H](O)c2ccccc21
InChIInChI=1S/C14H18O/c1-9(2)13-8-10(3)14(15)12-7-5-4-6-11(12)13/h4-10,14-15H,1-3H3/t10-,14-/m0/s1
InChIKeyLZAMEGYSZMRMRI-HZMBPMFUSA-N
MW202.30 g/mol
LogP3.41
Rot. Bonds1

About (1S,2S)-2-methyl-4-propan-2-yl-1,2-dihydronaphthalen-1-ol

(1S,2S)-2-methyl-4-propan-2-yl-1,2-dihydronaphthalen-1-ol (PubChem CID 134966420) has the molecular formula C14H18O and a molecular weight of 202.30 g/mol. Its IUPAC name is (1S,2S)-2-methyl-4-propan-2-yl-1,2-dihydronaphthalen-1-ol.

Molecular Properties

Compound Name(1S,2S)-2-methyl-4-propan-2-yl-1,2-dihydronaphthalen-1-ol
PubChem CID134966420
Molecular FormulaC14H18O
Molecular Weight202.30 g/mol
Exact Mass202.14
IUPAC Name(1S,2S)-2-methyl-4-propan-2-yl-1,2-dihydronaphthalen-1-ol
SMILESCC(C)C1=C[C@H](C)[C@H](O)c2ccccc21
InChIInChI=1S/C14H18O/c1-9(2)13-8-10(3)14(15)12-7-5-4-6-11(12)13/h4-10,14-15H,1-3H3/t10-,14-/m0/s1
InChIKeyLZAMEGYSZMRMRI-HZMBPMFUSA-N
XLogP3.41
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1S,2S)-2,4-dimethyl-1,2-dihydronaphthalen-1-ol
CID 102230606
(1R)-3-propan-2-yl-1-[2-[(1R)-3-propan-2-yl-1H-inden-1-yl]ethyl]-1H-indene
CID 102156149
3-propan-2-yl-1-[2-(3-propan-2-yl-1H-inden-1-yl)propan-2-yl]-1H-indene
CID 22595380
bis(2,3,4,5,6-pentafluorophenyl)-(3-propan-2-yl-1H-inden-1-yl)borane
CID 122371251
(1R,3R)-2-methyl-2,3-dihydro-1H-indene-1,3-diol
CID 10535021
8-methylbicyclo[4.2.0]octa-1,3,5-trien-7-ol
CID 12561909
(2R,3R)-3-hydroxy-2-methyl-2,3-dihydroinden-1-one
CID 10534997
(1S,2R)-2-ethyl-4-methyl-1,2-dihydronaphthalen-1-ol
CID 134970353
(1R,2R)-2-methyl-1,2-dihydronaphthalen-1-ol
CID 11252162
(1R,2S)-2-methyl-1,2-dihydronaphthalen-1-ol
CID 13056069
1-(3,4-dichlorophenyl)-4-propan-2-yl-1,2-dihydronaphthalene
CID 59143933
7,8-dimethylbicyclo[4.2.0]octa-1,3,5-triene;ethane
CID 159809006

Frequently Asked Questions

What is the IUPAC name of (1S,2S)-2-methyl-4-propan-2-yl-1,2-dihydronaphthalen-1-ol?
The IUPAC name of (1S,2S)-2-methyl-4-propan-2-yl-1,2-dihydronaphthalen-1-ol (CID 134966420) is (1S,2S)-2-methyl-4-propan-2-yl-1,2-dihydronaphthalen-1-ol.
What is the SMILES notation for (1S,2S)-2-methyl-4-propan-2-yl-1,2-dihydronaphthalen-1-ol?
The canonical SMILES for (1S,2S)-2-methyl-4-propan-2-yl-1,2-dihydronaphthalen-1-ol is CC(C)C1=C[C@H](C)[C@H](O)c2ccccc21.
What is the InChIKey of (1S,2S)-2-methyl-4-propan-2-yl-1,2-dihydronaphthalen-1-ol?
The InChIKey is LZAMEGYSZMRMRI-HZMBPMFUSA-N. The full InChI is InChI=1S/C14H18O/c1-9(2)13-8-10(3)14(15)12-7-5-4-6-11(12)13/h4-10,14-15H,1-3H3/t10-,14-/m0/s1.
What are the key properties of (1S,2S)-2-methyl-4-propan-2-yl-1,2-dihydronaphthalen-1-ol?
(1S,2S)-2-methyl-4-propan-2-yl-1,2-dihydronaphthalen-1-ol has a molecular weight of 202.30 g/mol, XLogP of 3.41, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1S,2S)-2-methyl-4-propan-2-yl-1,2-dihydronaphthalen-1-ol is sourced from PubChem (CID 134966420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).