(1R)-2-(benzylamino)-1-naphthalen-2-ylethanol

C19H19NO — CID 93383727

IUPAC(1R)-2-(benzylamino)-1-naphthalen-2-ylethanol
SMILESO[C@@H](CNCc1ccccc1)c1ccc2ccccc2c1
InChIInChI=1S/C19H19NO/c21-19(14-20-13-15-6-2-1-3-7-15)18-11-10-16-8-4-5-9-17(16)12-18/h1-12,19-21H,13-14H2/t19-/m0/s1
InChIKeyCTNYAHYHHWIJAG-IBGZPJMESA-N
MW277.37 g/mol
LogP3.66
Rot. Bonds5

About (1R)-2-(benzylamino)-1-naphthalen-2-ylethanol

(1R)-2-(benzylamino)-1-naphthalen-2-ylethanol (PubChem CID 93383727) has the molecular formula C19H19NO and a molecular weight of 277.37 g/mol. Its IUPAC name is (1R)-2-(benzylamino)-1-naphthalen-2-ylethanol.

Molecular Properties

Compound Name(1R)-2-(benzylamino)-1-naphthalen-2-ylethanol
PubChem CID93383727
Molecular FormulaC19H19NO
Molecular Weight277.37 g/mol
Exact Mass277.15
IUPAC Name(1R)-2-(benzylamino)-1-naphthalen-2-ylethanol
SMILESO[C@@H](CNCc1ccccc1)c1ccc2ccccc2c1
InChIInChI=1S/C19H19NO/c21-19(14-20-13-15-6-2-1-3-7-15)18-11-10-16-8-4-5-9-17(16)12-18/h1-12,19-21H,13-14H2/t19-/m0/s1
InChIKeyCTNYAHYHHWIJAG-IBGZPJMESA-N
XLogP3.66
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 53.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-benzyl-2-naphthalen-2-ylpropan-1-amine
CID 11011230
2-(benzylamino)-1-(4-propan-2-ylphenyl)ethanol
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2-(benzylamino)-1-(3,4-dichlorophenyl)ethanol
CID 70463218
1-naphthalen-2-yl-2-phenylethanol
CID 2793947
2-(benzylamino)-1-(4-phenylphenyl)ethanol
CID 12526842
3-[(2-hydroxy-2-naphthalen-2-ylethyl)amino]propan-1-ol
CID 60909589
2-(2,2-dimethylpropylamino)-1-naphthalen-2-ylethanol
CID 61167220
1-naphthalen-2-yl-2-(pyridazin-3-ylmethylamino)ethanol
CID 106895714
1-(2-hydroxy-2-naphthalen-2-ylethyl)-3-[(4-hydroxyphenyl)methyl]urea
CID 111111377
2-(2-methoxyethylamino)-1-naphthalen-2-ylethanol
CID 60903871
2-(cyclohexylmethylamino)-1-naphthalen-2-ylethanol
CID 60901818
2-(2-cyclopropylpropylamino)-1-naphthalen-2-ylethanol
CID 115591800

Frequently Asked Questions

What is the IUPAC name of (1R)-2-(benzylamino)-1-naphthalen-2-ylethanol?
The IUPAC name of (1R)-2-(benzylamino)-1-naphthalen-2-ylethanol (CID 93383727) is (1R)-2-(benzylamino)-1-naphthalen-2-ylethanol.
What is the SMILES notation for (1R)-2-(benzylamino)-1-naphthalen-2-ylethanol?
The canonical SMILES for (1R)-2-(benzylamino)-1-naphthalen-2-ylethanol is O[C@@H](CNCc1ccccc1)c1ccc2ccccc2c1.
What is the InChIKey of (1R)-2-(benzylamino)-1-naphthalen-2-ylethanol?
The InChIKey is CTNYAHYHHWIJAG-IBGZPJMESA-N. The full InChI is InChI=1S/C19H19NO/c21-19(14-20-13-15-6-2-1-3-7-15)18-11-10-16-8-4-5-9-17(16)12-18/h1-12,19-21H,13-14H2/t19-/m0/s1.
What are the key properties of (1R)-2-(benzylamino)-1-naphthalen-2-ylethanol?
(1R)-2-(benzylamino)-1-naphthalen-2-ylethanol has a molecular weight of 277.37 g/mol, XLogP of 3.66, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-2-(benzylamino)-1-naphthalen-2-ylethanol is sourced from PubChem (CID 93383727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).