2-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]ethanol

C13H19NO2 — CID 3016750

IUPAC2-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]ethanol
SMILESCOc1ccc2c(c1)CCCC2NCCO
InChIInChI=1S/C13H19NO2/c1-16-11-5-6-12-10(9-11)3-2-4-13(12)14-7-8-15/h5-6,9,13-15H,2-4,7-8H2,1H3
InChIKeyWUEGURCTOLIBIO-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.65
Rot. Bonds4

About 2-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]ethanol

2-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]ethanol (PubChem CID 3016750) has the molecular formula C13H19NO2 and a molecular weight of 221.30 g/mol. Its IUPAC name is 2-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]ethanol.

Molecular Properties

Compound Name2-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]ethanol
PubChem CID3016750
Molecular FormulaC13H19NO2
Molecular Weight221.30 g/mol
Exact Mass221.14
IUPAC Name2-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]ethanol
SMILESCOc1ccc2c(c1)CCCC2NCCO
InChIInChI=1S/C13H19NO2/c1-16-11-5-6-12-10(9-11)3-2-4-13(12)14-7-8-15/h5-6,9,13-15H,2-4,7-8H2,1H3
InChIKeyWUEGURCTOLIBIO-UHFFFAOYSA-N
XLogP1.65
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]propan-1-ol
CID 43206577
3-[[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]amino]propanenitrile
CID 28728583
3-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]-2,2-dimethylpropan-1-ol
CID 115359037
methyl 4-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]butanoate
CID 60782387
4-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]-3,3-dimethylbutan-1-ol
CID 103787626
3-[[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]methyl]pentan-3-ol
CID 65105549
6-methoxy-N-(5-methylhexyl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115324453
6-methoxy-N-(2-methoxy-2-methylpropyl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115728733
1-cyclopropyl-2-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]ethanol
CID 55172738
6-methoxy-N-(2-thiomorpholin-4-ylethyl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 103783282
N-(2-methoxyethyl)-2-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]acetamide
CID 115708011
6-methoxy-N-(4-methoxy-2,2-dimethylbutyl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 104628924

Frequently Asked Questions

What is the IUPAC name of 2-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]ethanol?
The IUPAC name of 2-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]ethanol (CID 3016750) is 2-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]ethanol.
What is the SMILES notation for 2-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]ethanol?
The canonical SMILES for 2-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]ethanol is COc1ccc2c(c1)CCCC2NCCO.
What is the InChIKey of 2-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]ethanol?
The InChIKey is WUEGURCTOLIBIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO2/c1-16-11-5-6-12-10(9-11)3-2-4-13(12)14-7-8-15/h5-6,9,13-15H,2-4,7-8H2,1H3.
What are the key properties of 2-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]ethanol?
2-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]ethanol has a molecular weight of 221.30 g/mol, XLogP of 1.65, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]ethanol is sourced from PubChem (CID 3016750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).