2-[ethyl(2-hydroxyethyl)amino]-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol

C16H25NO2 — CID 82215823

IUPAC2-[ethyl(2-hydroxyethyl)amino]-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol
SMILESCCN(CCO)CC(O)c1ccc2c(c1)CCCC2
InChIInChI=1S/C16H25NO2/c1-2-17(9-10-18)12-16(19)15-8-7-13-5-3-4-6-14(13)11-15/h7-8,11,16,18-19H,2-6,9-10,12H2,1H3
InChIKeyBUFUCNBOXWXXBX-UHFFFAOYSA-N
MW263.38 g/mol
LogP1.91
Rot. Bonds6

About 2-[ethyl(2-hydroxyethyl)amino]-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol

2-[ethyl(2-hydroxyethyl)amino]-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol (PubChem CID 82215823) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is 2-[ethyl(2-hydroxyethyl)amino]-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol.

Molecular Properties

Compound Name2-[ethyl(2-hydroxyethyl)amino]-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol
PubChem CID82215823
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC Name2-[ethyl(2-hydroxyethyl)amino]-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol
SMILESCCN(CCO)CC(O)c1ccc2c(c1)CCCC2
InChIInChI=1S/C16H25NO2/c1-2-17(9-10-18)12-16(19)15-8-7-13-5-3-4-6-14(13)11-15/h7-8,11,16,18-19H,2-6,9-10,12H2,1H3
InChIKeyBUFUCNBOXWXXBX-UHFFFAOYSA-N
XLogP1.91
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[ethyl(2-hydroxyethyl)amino]ethanol
CID 94954558
3-[benzyl(ethyl)amino]-1-(5,6,7,8-tetrahydronaphthalen-2-yl)propan-1-ol
CID 82073593
6-[2-[ethyl(2-hydroxyethyl)amino]-1-hydroxyethyl]-4H-1,4-benzoxazin-3-one
CID 82216264
3-sulfanyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)propan-1-ol
CID 116830936
3-methylsulfanyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)propan-1-ol
CID 116831085
(1S)-2-amino-1-(2,3-dihydro-1H-inden-5-yl)ethanol
CID 83001263
2-[bis(2-hydroxyethyl)amino]-1-(3,4-difluorophenyl)ethanol
CID 82217071
3-hydroxy-3-(5,6,7,8-tetrahydronaphthalen-2-yl)propanoic acid
CID 82366719
3-amino-1-(6,7,8,9-tetrahydro-5H-benzo[7]annulen-3-yl)propan-1-ol
CID 84684971
2-(butan-2-ylamino)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol;hydrochloride
CID 3029491
2-[bis(2-hydroxyethyl)amino]-1-(3-bromophenyl)ethanol
CID 82216688
2-pyrrolidin-1-yl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol
CID 82118360

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl(2-hydroxyethyl)amino]-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol?
The IUPAC name of 2-[ethyl(2-hydroxyethyl)amino]-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol (CID 82215823) is 2-[ethyl(2-hydroxyethyl)amino]-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol.
What is the SMILES notation for 2-[ethyl(2-hydroxyethyl)amino]-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol?
The canonical SMILES for 2-[ethyl(2-hydroxyethyl)amino]-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol is CCN(CCO)CC(O)c1ccc2c(c1)CCCC2.
What is the InChIKey of 2-[ethyl(2-hydroxyethyl)amino]-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol?
The InChIKey is BUFUCNBOXWXXBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-2-17(9-10-18)12-16(19)15-8-7-13-5-3-4-6-14(13)11-15/h7-8,11,16,18-19H,2-6,9-10,12H2,1H3.
What are the key properties of 2-[ethyl(2-hydroxyethyl)amino]-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol?
2-[ethyl(2-hydroxyethyl)amino]-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol has a molecular weight of 263.38 g/mol, XLogP of 1.91, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl(2-hydroxyethyl)amino]-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol is sourced from PubChem (CID 82215823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).