2-(2,3-dimethylpiperidin-1-yl)-1-naphthalen-2-ylethanol

C19H25NO — CID 62122893

IUPAC2-(2,3-dimethylpiperidin-1-yl)-1-naphthalen-2-ylethanol
SMILESCC1CCCN(CC(O)c2ccc3ccccc3c2)C1C
InChIInChI=1S/C19H25NO/c1-14-6-5-11-20(15(14)2)13-19(21)18-10-9-16-7-3-4-8-17(16)12-18/h3-4,7-10,12,14-15,19,21H,5-6,11,13H2,1-2H3
InChIKeyVMCHUYAALHJQOQ-UHFFFAOYSA-N
MW283.42 g/mol
LogP3.99
Rot. Bonds3

About 2-(2,3-dimethylpiperidin-1-yl)-1-naphthalen-2-ylethanol

2-(2,3-dimethylpiperidin-1-yl)-1-naphthalen-2-ylethanol (PubChem CID 62122893) has the molecular formula C19H25NO and a molecular weight of 283.42 g/mol. Its IUPAC name is 2-(2,3-dimethylpiperidin-1-yl)-1-naphthalen-2-ylethanol.

Molecular Properties

Compound Name2-(2,3-dimethylpiperidin-1-yl)-1-naphthalen-2-ylethanol
PubChem CID62122893
Molecular FormulaC19H25NO
Molecular Weight283.42 g/mol
Exact Mass283.19
IUPAC Name2-(2,3-dimethylpiperidin-1-yl)-1-naphthalen-2-ylethanol
SMILESCC1CCCN(CC(O)c2ccc3ccccc3c2)C1C
InChIInChI=1S/C19H25NO/c1-14-6-5-11-20(15(14)2)13-19(21)18-10-9-16-7-3-4-8-17(16)12-18/h3-4,7-10,12,14-15,19,21H,5-6,11,13H2,1-2H3
InChIKeyVMCHUYAALHJQOQ-UHFFFAOYSA-N
XLogP3.99
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(1-benzofuran-2-yl)-2-(2,3-dimethylpiperidin-1-yl)ethanol
CID 62123428
1-(2-hydroxy-2-naphthalen-2-ylethyl)-4-methylpyrrolidin-2-one
CID 63100802
(1R)-2-[(3R)-3-(2-methylpyrazol-3-yl)piperidin-1-yl]-1-naphthalen-2-ylethanol
CID 97075133
2-[methyl-(1-methylpiperidin-4-yl)amino]-1-naphthalen-2-ylethanol
CID 82216002
methyl 3-(2,3-dimethylpiperidin-1-yl)-2-phenylpropanoate
CID 64566277
(1S)-2-[(3S)-3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-1-naphthalen-2-ylethanol
CID 100839467
(2S)-1-acetyl-N-[(2R)-2-hydroxy-2-naphthalen-2-ylethyl]pyrrolidine-2-carboxamide
CID 97227605
3-(2-hydroxy-2-naphthalen-2-ylethyl)-1-methylimidazolidine-2,4-dione
CID 60969409
1-naphthalen-2-yl-2-[4-(2-phenylethyl)piperazin-1-yl]ethanol
CID 24784909
2-(3,4-dihydro-2H-quinolin-1-yl)-1-naphthalen-2-ylethanol
CID 82216010
(1S)-2-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]-1-(4-methoxyphenyl)ethanol
CID 10801648
cyclopentyl(naphthalen-2-yl)methanol
CID 62715022

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dimethylpiperidin-1-yl)-1-naphthalen-2-ylethanol?
The IUPAC name of 2-(2,3-dimethylpiperidin-1-yl)-1-naphthalen-2-ylethanol (CID 62122893) is 2-(2,3-dimethylpiperidin-1-yl)-1-naphthalen-2-ylethanol.
What is the SMILES notation for 2-(2,3-dimethylpiperidin-1-yl)-1-naphthalen-2-ylethanol?
The canonical SMILES for 2-(2,3-dimethylpiperidin-1-yl)-1-naphthalen-2-ylethanol is CC1CCCN(CC(O)c2ccc3ccccc3c2)C1C.
What is the InChIKey of 2-(2,3-dimethylpiperidin-1-yl)-1-naphthalen-2-ylethanol?
The InChIKey is VMCHUYAALHJQOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-14-6-5-11-20(15(14)2)13-19(21)18-10-9-16-7-3-4-8-17(16)12-18/h3-4,7-10,12,14-15,19,21H,5-6,11,13H2,1-2H3.
What are the key properties of 2-(2,3-dimethylpiperidin-1-yl)-1-naphthalen-2-ylethanol?
2-(2,3-dimethylpiperidin-1-yl)-1-naphthalen-2-ylethanol has a molecular weight of 283.42 g/mol, XLogP of 3.99, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dimethylpiperidin-1-yl)-1-naphthalen-2-ylethanol is sourced from PubChem (CID 62122893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).