1-(6-methoxynaphthalen-2-yl)butan-2-ol

C15H18O2 — CID 67660924

IUPAC1-(6-methoxynaphthalen-2-yl)butan-2-ol
SMILESCCC(O)Cc1ccc2cc(OC)ccc2c1
InChIInChI=1S/C15H18O2/c1-3-14(16)9-11-4-5-13-10-15(17-2)7-6-12(13)8-11/h4-8,10,14,16H,3,9H2,1-2H3
InChIKeyRPJDGHKBNZTYJC-UHFFFAOYSA-N
MW230.31 g/mol
LogP3.16
Rot. Bonds4

About 1-(6-methoxynaphthalen-2-yl)butan-2-ol

1-(6-methoxynaphthalen-2-yl)butan-2-ol (PubChem CID 67660924) has the molecular formula C15H18O2 and a molecular weight of 230.31 g/mol. Its IUPAC name is 1-(6-methoxynaphthalen-2-yl)butan-2-ol.

Molecular Properties

Compound Name1-(6-methoxynaphthalen-2-yl)butan-2-ol
PubChem CID67660924
Molecular FormulaC15H18O2
Molecular Weight230.31 g/mol
Exact Mass230.13
IUPAC Name1-(6-methoxynaphthalen-2-yl)butan-2-ol
SMILESCCC(O)Cc1ccc2cc(OC)ccc2c1
InChIInChI=1S/C15H18O2/c1-3-14(16)9-11-4-5-13-10-15(17-2)7-6-12(13)8-11/h4-8,10,14,16H,3,9H2,1-2H3
InChIKeyRPJDGHKBNZTYJC-UHFFFAOYSA-N
XLogP3.16
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-anthracen-2-ylbutan-2-ol
CID 141488114
4-(6-methoxynaphthalen-2-yl)-3-methylbutanoic acid
CID 116926814
1-(3,5-dimethylphenyl)-3-(4-methoxyphenyl)propan-2-ol
CID 61375136
(2S)-2-[(6-methoxynaphthalen-2-yl)methylamino]butan-1-ol
CID 28723100
3-[(6-methoxynaphthalen-2-yl)methylamino]propane-1,2-diol
CID 66175454
1-(4-methoxyphenyl)pentan-2-ol
CID 61375325
1-[(4-methoxyphenyl)methylamino]butan-2-ol
CID 23060649
methyl (2S)-2-amino-3-(6-methoxynaphthalen-2-yl)propanoate
CID 171238349
N-[(6-methoxynaphthalen-2-yl)methyl]-2-methylpentan-3-amine
CID 61468865
(2S)-1-methoxy-3-(4-methoxyphenyl)propan-2-ol
CID 101107331
1-(4-ethoxyphenyl)butan-2-ol
CID 82161585
1-(4-methoxyphenyl)hexan-2-ol
CID 62608607

Frequently Asked Questions

What is the IUPAC name of 1-(6-methoxynaphthalen-2-yl)butan-2-ol?
The IUPAC name of 1-(6-methoxynaphthalen-2-yl)butan-2-ol (CID 67660924) is 1-(6-methoxynaphthalen-2-yl)butan-2-ol.
What is the SMILES notation for 1-(6-methoxynaphthalen-2-yl)butan-2-ol?
The canonical SMILES for 1-(6-methoxynaphthalen-2-yl)butan-2-ol is CCC(O)Cc1ccc2cc(OC)ccc2c1.
What is the InChIKey of 1-(6-methoxynaphthalen-2-yl)butan-2-ol?
The InChIKey is RPJDGHKBNZTYJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18O2/c1-3-14(16)9-11-4-5-13-10-15(17-2)7-6-12(13)8-11/h4-8,10,14,16H,3,9H2,1-2H3.
What are the key properties of 1-(6-methoxynaphthalen-2-yl)butan-2-ol?
1-(6-methoxynaphthalen-2-yl)butan-2-ol has a molecular weight of 230.31 g/mol, XLogP of 3.16, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-methoxynaphthalen-2-yl)butan-2-ol is sourced from PubChem (CID 67660924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).