[(1R,2S)-2-propan-2-yl-1,2-dihydronaphthalen-1-yl]methanol

C14H18O — CID 10726808

IUPAC[(1R,2S)-2-propan-2-yl-1,2-dihydronaphthalen-1-yl]methanol
SMILESCC(C)[C@H]1C=Cc2ccccc2[C@@H]1CO
InChIInChI=1S/C14H18O/c1-10(2)12-8-7-11-5-3-4-6-13(11)14(12)9-15/h3-8,10,12,14-15H,9H2,1-2H3/t12-,14-/m1/s1
InChIKeyHFWMMTSVRDAZTE-TZMCWYRMSA-N
MW202.30 g/mol
LogP3.06
Rot. Bonds2

About [(1R,2S)-2-propan-2-yl-1,2-dihydronaphthalen-1-yl]methanol

[(1R,2S)-2-propan-2-yl-1,2-dihydronaphthalen-1-yl]methanol (PubChem CID 10726808) has the molecular formula C14H18O and a molecular weight of 202.30 g/mol. Its IUPAC name is [(1R,2S)-2-propan-2-yl-1,2-dihydronaphthalen-1-yl]methanol.

Molecular Properties

Compound Name[(1R,2S)-2-propan-2-yl-1,2-dihydronaphthalen-1-yl]methanol
PubChem CID10726808
Molecular FormulaC14H18O
Molecular Weight202.30 g/mol
Exact Mass202.14
IUPAC Name[(1R,2S)-2-propan-2-yl-1,2-dihydronaphthalen-1-yl]methanol
SMILESCC(C)[C@H]1C=Cc2ccccc2[C@@H]1CO
InChIInChI=1S/C14H18O/c1-10(2)12-8-7-11-5-3-4-6-13(11)14(12)9-15/h3-8,10,12,14-15H,9H2,1-2H3/t12-,14-/m1/s1
InChIKeyHFWMMTSVRDAZTE-TZMCWYRMSA-N
XLogP3.06
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

11-oxatricyclo[6.2.1.02,7]undeca-2,4,6,9-tetraene;(1S,2R)-2-propan-2-yl-1,2-dihydronaphthalen-1-ol
CID 157187366
2-(1H-inden-1-yl)ethanol
CID 23288751
1H-inden-1-ylmethanol;zirconium(3+);trichloride
CID 160514692
1-(2-hydroxy-1,2-dihydronaphthalen-1-yl)-1,2-dihydronaphthalen-2-ol
CID 71289286
sodium;hydride;1-[1-(1H-inden-1-yl)ethyl]-1H-indene
CID 173341503
2-butan-2-yl-N,N-di(heptan-4-yl)-1,2-dihydronaphthalene-1-carboxamide
CID 11796655
ethanol;tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaen-2-ol
CID 67954177
CID 54557103
CID 54557103
1-(5-propan-2-yl-3-propan-2-ylidenecyclopenta-1,4-dien-1-yl)-1H-indene
CID 173157708
hydron;1H-inden-1-ol
CID 174812636
(1R,2R)-2-methyl-1,2-dihydronaphthalen-1-ol
CID 11252162
(1R,2S)-2-methyl-1,2-dihydronaphthalen-1-ol
CID 13056069

Frequently Asked Questions

What is the IUPAC name of [(1R,2S)-2-propan-2-yl-1,2-dihydronaphthalen-1-yl]methanol?
The IUPAC name of [(1R,2S)-2-propan-2-yl-1,2-dihydronaphthalen-1-yl]methanol (CID 10726808) is [(1R,2S)-2-propan-2-yl-1,2-dihydronaphthalen-1-yl]methanol.
What is the SMILES notation for [(1R,2S)-2-propan-2-yl-1,2-dihydronaphthalen-1-yl]methanol?
The canonical SMILES for [(1R,2S)-2-propan-2-yl-1,2-dihydronaphthalen-1-yl]methanol is CC(C)[C@H]1C=Cc2ccccc2[C@@H]1CO.
What is the InChIKey of [(1R,2S)-2-propan-2-yl-1,2-dihydronaphthalen-1-yl]methanol?
The InChIKey is HFWMMTSVRDAZTE-TZMCWYRMSA-N. The full InChI is InChI=1S/C14H18O/c1-10(2)12-8-7-11-5-3-4-6-13(11)14(12)9-15/h3-8,10,12,14-15H,9H2,1-2H3/t12-,14-/m1/s1.
What are the key properties of [(1R,2S)-2-propan-2-yl-1,2-dihydronaphthalen-1-yl]methanol?
[(1R,2S)-2-propan-2-yl-1,2-dihydronaphthalen-1-yl]methanol has a molecular weight of 202.30 g/mol, XLogP of 3.06, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R,2S)-2-propan-2-yl-1,2-dihydronaphthalen-1-yl]methanol is sourced from PubChem (CID 10726808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).