2-[cyclobutyl(naphthalen-1-ylmethyl)amino]ethanol

C17H21NO — CID 102677069

IUPAC2-[cyclobutyl(naphthalen-1-ylmethyl)amino]ethanol
SMILESOCCN(Cc1cccc2ccccc12)C1CCC1
InChIInChI=1S/C17H21NO/c19-12-11-18(16-8-4-9-16)13-15-7-3-6-14-5-1-2-10-17(14)15/h1-3,5-7,10,16,19H,4,8-9,11-13H2
InChIKeyDGTFIGZOQXWQHO-UHFFFAOYSA-N
MW255.36 g/mol
LogP3.19
Rot. Bonds5

About 2-[cyclobutyl(naphthalen-1-ylmethyl)amino]ethanol

2-[cyclobutyl(naphthalen-1-ylmethyl)amino]ethanol (PubChem CID 102677069) has the molecular formula C17H21NO and a molecular weight of 255.36 g/mol. Its IUPAC name is 2-[cyclobutyl(naphthalen-1-ylmethyl)amino]ethanol.

Molecular Properties

Compound Name2-[cyclobutyl(naphthalen-1-ylmethyl)amino]ethanol
PubChem CID102677069
Molecular FormulaC17H21NO
Molecular Weight255.36 g/mol
Exact Mass255.16
IUPAC Name2-[cyclobutyl(naphthalen-1-ylmethyl)amino]ethanol
SMILESOCCN(Cc1cccc2ccccc12)C1CCC1
InChIInChI=1S/C17H21NO/c19-12-11-18(16-8-4-9-16)13-15-7-3-6-14-5-1-2-10-17(14)15/h1-3,5-7,10,16,19H,4,8-9,11-13H2
InChIKeyDGTFIGZOQXWQHO-UHFFFAOYSA-N
XLogP3.19
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-bromopropyl)-N-(naphthalen-1-ylmethyl)cyclobutanamine
CID 102860169
2-[cyclobutyl(quinolin-4-ylmethyl)amino]ethanol
CID 102679767
2-[cyclopentyl(quinolin-8-ylmethyl)amino]ethanol
CID 60912446
2-[cyclopropyl(quinolin-8-ylmethyl)amino]ethanol
CID 60510570
2-[cyclopentyl-[[2-(difluoromethoxy)phenyl]methyl]amino]ethanol
CID 62016633
3-[cyclobutyl(quinolin-8-ylmethyl)amino]propan-1-ol
CID 102848366
2-[cyclohexyl-[[2-(difluoromethoxy)phenyl]methyl]amino]ethanol
CID 62014264
3-[[cyclopentyl(2-hydroxyethyl)amino]methyl]-2-fluorobenzenecarboximidamide
CID 107117850
N-benzyl-3-[cyclopropyl(naphthalen-1-ylmethyl)amino]-N-methylpropanamide
CID 84562999
2-amino-6-[[cyclohexyl(2-hydroxyethyl)amino]methyl]benzoic acid
CID 104824537
3-[cyclopropyl(naphthalen-1-ylmethyl)amino]-1-(2-methylpiperidin-1-yl)propan-1-one
CID 84562994
2-[cyclobutyl-[(6-fluoroquinolin-8-yl)methyl]amino]ethanol
CID 102677075

Frequently Asked Questions

What is the IUPAC name of 2-[cyclobutyl(naphthalen-1-ylmethyl)amino]ethanol?
The IUPAC name of 2-[cyclobutyl(naphthalen-1-ylmethyl)amino]ethanol (CID 102677069) is 2-[cyclobutyl(naphthalen-1-ylmethyl)amino]ethanol.
What is the SMILES notation for 2-[cyclobutyl(naphthalen-1-ylmethyl)amino]ethanol?
The canonical SMILES for 2-[cyclobutyl(naphthalen-1-ylmethyl)amino]ethanol is OCCN(Cc1cccc2ccccc12)C1CCC1.
What is the InChIKey of 2-[cyclobutyl(naphthalen-1-ylmethyl)amino]ethanol?
The InChIKey is DGTFIGZOQXWQHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO/c19-12-11-18(16-8-4-9-16)13-15-7-3-6-14-5-1-2-10-17(14)15/h1-3,5-7,10,16,19H,4,8-9,11-13H2.
What are the key properties of 2-[cyclobutyl(naphthalen-1-ylmethyl)amino]ethanol?
2-[cyclobutyl(naphthalen-1-ylmethyl)amino]ethanol has a molecular weight of 255.36 g/mol, XLogP of 3.19, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclobutyl(naphthalen-1-ylmethyl)amino]ethanol is sourced from PubChem (CID 102677069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).