[6-(3-methylbutan-2-yl)naphthalen-2-yl]methanol

C16H20O — CID 153437397

IUPAC[6-(3-methylbutan-2-yl)naphthalen-2-yl]methanol
SMILESCC(C)C(C)c1ccc2cc(CO)ccc2c1
InChIInChI=1S/C16H20O/c1-11(2)12(3)14-6-7-15-8-13(10-17)4-5-16(15)9-14/h4-9,11-12,17H,10H2,1-3H3
InChIKeyYXNJIJSEZQFKTB-UHFFFAOYSA-N
MW228.33 g/mol
LogP4.09
Rot. Bonds3

About [6-(3-methylbutan-2-yl)naphthalen-2-yl]methanol

[6-(3-methylbutan-2-yl)naphthalen-2-yl]methanol (PubChem CID 153437397) has the molecular formula C16H20O and a molecular weight of 228.33 g/mol. Its IUPAC name is [6-(3-methylbutan-2-yl)naphthalen-2-yl]methanol.

Molecular Properties

Compound Name[6-(3-methylbutan-2-yl)naphthalen-2-yl]methanol
PubChem CID153437397
Molecular FormulaC16H20O
Molecular Weight228.33 g/mol
Exact Mass228.15
IUPAC Name[6-(3-methylbutan-2-yl)naphthalen-2-yl]methanol
SMILESCC(C)C(C)c1ccc2cc(CO)ccc2c1
InChIInChI=1S/C16H20O/c1-11(2)12(3)14-6-7-15-8-13(10-17)4-5-16(15)9-14/h4-9,11-12,17H,10H2,1-3H3
InChIKeyYXNJIJSEZQFKTB-UHFFFAOYSA-N
XLogP4.09
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.33
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[6-(hydroxymethyl)naphthalen-2-yl]methanol
CID 11788722
[4-(1-fluoro-3-methylbutan-2-yl)phenyl]methanol
CID 115020728
2-methyl-3-[4-(3-methylbutan-2-yl)phenyl]propan-1-ol
CID 169444062
[4-(2,5-dimethylhexan-3-yl)phenyl]methanol
CID 58807001
(1S)-1-[4-(hydroxymethyl)phenyl]ethanol
CID 130747007
butan-2-ylbenzene;6-butan-2-ylnaphthalen-2-ol;(4-butan-2-ylphenyl)methanol
CID 161227870
1-(6-prop-2-enylnaphthalen-2-yl)ethanol
CID 67804497
(2S)-2-(6-ethylnaphthalen-2-yl)propanoic acid
CID 149459018
(2S)-2-[4-(hydroxymethyl)phenyl]propan-1-ol
CID 10374791
[4-(3-methylbutan-2-yl)phenyl]methanamine
CID 115015008
2-(methoxymethyl)-6-propan-2-ylnaphthalene
CID 142029465
2-[6-(methoxymethyl)naphthalen-2-yl]propanoyl chloride
CID 143282604

Frequently Asked Questions

What is the IUPAC name of [6-(3-methylbutan-2-yl)naphthalen-2-yl]methanol?
The IUPAC name of [6-(3-methylbutan-2-yl)naphthalen-2-yl]methanol (CID 153437397) is [6-(3-methylbutan-2-yl)naphthalen-2-yl]methanol.
What is the SMILES notation for [6-(3-methylbutan-2-yl)naphthalen-2-yl]methanol?
The canonical SMILES for [6-(3-methylbutan-2-yl)naphthalen-2-yl]methanol is CC(C)C(C)c1ccc2cc(CO)ccc2c1.
What is the InChIKey of [6-(3-methylbutan-2-yl)naphthalen-2-yl]methanol?
The InChIKey is YXNJIJSEZQFKTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20O/c1-11(2)12(3)14-6-7-15-8-13(10-17)4-5-16(15)9-14/h4-9,11-12,17H,10H2,1-3H3.
What are the key properties of [6-(3-methylbutan-2-yl)naphthalen-2-yl]methanol?
[6-(3-methylbutan-2-yl)naphthalen-2-yl]methanol has a molecular weight of 228.33 g/mol, XLogP of 4.09, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(3-methylbutan-2-yl)naphthalen-2-yl]methanol is sourced from PubChem (CID 153437397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).