(1S)-1,6-dimethyl-4-propan-2-yl-3,4-dihydro-2H-naphthalen-1-ol

C15H22O — CID 91747482

IUPAC(1S)-1,6-dimethyl-4-propan-2-yl-3,4-dihydro-2H-naphthalen-1-ol
SMILESCc1ccc2c(c1)C(C(C)C)CC[C@]2(C)O
InChIInChI=1S/C15H22O/c1-10(2)12-7-8-15(4,16)14-6-5-11(3)9-13(12)14/h5-6,9-10,12,16H,7-8H2,1-4H3/t12?,15-/m0/s1
InChIKeyMTOMOICLIZNIAM-CVRLYYSRSA-N
MW218.34 g/mol
LogP3.74
Rot. Bonds1

About (1S)-1,6-dimethyl-4-propan-2-yl-3,4-dihydro-2H-naphthalen-1-ol

(1S)-1,6-dimethyl-4-propan-2-yl-3,4-dihydro-2H-naphthalen-1-ol (PubChem CID 91747482) has the molecular formula C15H22O and a molecular weight of 218.34 g/mol. Its IUPAC name is (1S)-1,6-dimethyl-4-propan-2-yl-3,4-dihydro-2H-naphthalen-1-ol.

Molecular Properties

Compound Name(1S)-1,6-dimethyl-4-propan-2-yl-3,4-dihydro-2H-naphthalen-1-ol
PubChem CID91747482
Molecular FormulaC15H22O
Molecular Weight218.34 g/mol
Exact Mass218.17
IUPAC Name(1S)-1,6-dimethyl-4-propan-2-yl-3,4-dihydro-2H-naphthalen-1-ol
SMILESCc1ccc2c(c1)C(C(C)C)CC[C@]2(C)O
InChIInChI=1S/C15H22O/c1-10(2)12-7-8-15(4,16)14-6-5-11(3)9-13(12)14/h5-6,9-10,12,16H,7-8H2,1-4H3/t12?,15-/m0/s1
InChIKeyMTOMOICLIZNIAM-CVRLYYSRSA-N
XLogP3.74
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1R)-4,4,7-trimethyl-1-propan-2-yl-2,3-dihydro-1H-naphthalene
CID 98564559
methyl 5-hydroxy-5-methyl-8-propan-2-yl-7,8-dihydro-6H-naphthalene-2-carboxylate
CID 162953914
(1S,4S)-1,6-dimethyl-4-propan-2-yl-1,2,3,4-tetrahydronaphthalene
CID 6429077
(4R)-6-methyl-4-propan-2-yl-3,4-dihydro-2H-chromene
CID 167327532
3-hydroxy-3-methyl-6-propan-2-ylcyclohexane-1,2-dione
CID 12972800
6-methyl-1-propan-2-yl-1,2,3,4-tetrahydronaphthalene
CID 59559014
(4S)-4-hydroxy-4,7-dimethyl-2,3-dihydronaphthalen-1-one
CID 102352796
8-methyl-5-propan-2-yl-1,3,4,5-tetrahydro-1-benzazepin-2-one
CID 10443350
1-(2,4-dimethylphenyl)-4-propan-2-ylcyclohexan-1-amine
CID 63411288
4,8,11,11-tetramethyl-9,10-dioxatricyclo[6.3.2.02,7]trideca-2(7),3,5-triene
CID 10399059
2,4-dimethyl-6-propan-2-yl-6,7-dihydro-5H-1-benzofuran-4-ol;2-methylpropane
CID 155577682
(2aS,8R,8aS)-2a,5,8-trimethyl-2,8a-dihydro-1H-cyclobuta[b]chromen-8-ol
CID 11096080

Frequently Asked Questions

What is the IUPAC name of (1S)-1,6-dimethyl-4-propan-2-yl-3,4-dihydro-2H-naphthalen-1-ol?
The IUPAC name of (1S)-1,6-dimethyl-4-propan-2-yl-3,4-dihydro-2H-naphthalen-1-ol (CID 91747482) is (1S)-1,6-dimethyl-4-propan-2-yl-3,4-dihydro-2H-naphthalen-1-ol.
What is the SMILES notation for (1S)-1,6-dimethyl-4-propan-2-yl-3,4-dihydro-2H-naphthalen-1-ol?
The canonical SMILES for (1S)-1,6-dimethyl-4-propan-2-yl-3,4-dihydro-2H-naphthalen-1-ol is Cc1ccc2c(c1)C(C(C)C)CC[C@]2(C)O.
What is the InChIKey of (1S)-1,6-dimethyl-4-propan-2-yl-3,4-dihydro-2H-naphthalen-1-ol?
The InChIKey is MTOMOICLIZNIAM-CVRLYYSRSA-N. The full InChI is InChI=1S/C15H22O/c1-10(2)12-7-8-15(4,16)14-6-5-11(3)9-13(12)14/h5-6,9-10,12,16H,7-8H2,1-4H3/t12?,15-/m0/s1.
What are the key properties of (1S)-1,6-dimethyl-4-propan-2-yl-3,4-dihydro-2H-naphthalen-1-ol?
(1S)-1,6-dimethyl-4-propan-2-yl-3,4-dihydro-2H-naphthalen-1-ol has a molecular weight of 218.34 g/mol, XLogP of 3.74, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1,6-dimethyl-4-propan-2-yl-3,4-dihydro-2H-naphthalen-1-ol is sourced from PubChem (CID 91747482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).