2-[cyclobutyl(quinolin-4-ylmethyl)amino]ethanol

C16H20N2O — CID 102679767

IUPAC2-[cyclobutyl(quinolin-4-ylmethyl)amino]ethanol
SMILESOCCN(Cc1ccnc2ccccc12)C1CCC1
InChIInChI=1S/C16H20N2O/c19-11-10-18(14-4-3-5-14)12-13-8-9-17-16-7-2-1-6-15(13)16/h1-2,6-9,14,19H,3-5,10-12H2
InChIKeyBLSIULXPICMREY-UHFFFAOYSA-N
MW256.35 g/mol
LogP2.58
Rot. Bonds5

About 2-[cyclobutyl(quinolin-4-ylmethyl)amino]ethanol

2-[cyclobutyl(quinolin-4-ylmethyl)amino]ethanol (PubChem CID 102679767) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is 2-[cyclobutyl(quinolin-4-ylmethyl)amino]ethanol.

Molecular Properties

Compound Name2-[cyclobutyl(quinolin-4-ylmethyl)amino]ethanol
PubChem CID102679767
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC Name2-[cyclobutyl(quinolin-4-ylmethyl)amino]ethanol
SMILESOCCN(Cc1ccnc2ccccc12)C1CCC1
InChIInChI=1S/C16H20N2O/c19-11-10-18(14-4-3-5-14)12-13-8-9-17-16-7-2-1-6-15(13)16/h1-2,6-9,14,19H,3-5,10-12H2
InChIKeyBLSIULXPICMREY-UHFFFAOYSA-N
XLogP2.58
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-bromoethyl)-N-(quinolin-4-ylmethyl)cyclobutanamine
CID 102860813
2-[cyclobutyl(naphthalen-1-ylmethyl)amino]ethanol
CID 102677069
2-[cyclopentyl(quinolin-8-ylmethyl)amino]ethanol
CID 60912446
2-[2,2-difluoroethyl(quinolin-4-ylmethyl)amino]ethanol
CID 107485059
N-methyl-N-(quinolin-4-ylmethyl)piperidin-3-amine
CID 63868534
2-[cyclopentyl(quinolin-6-ylmethyl)amino]ethanol
CID 62015236
3-[[cyclohexyl(2-hydroxyethyl)amino]methyl]pyridine-2-carbothioamide
CID 62893452
N-(quinolin-4-ylmethyl)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]cyclopropanamine
CID 50979401
4-[cyclopropyl-[(2-methylquinolin-4-yl)methyl]amino]butan-1-ol
CID 111457060
2-[cyclobutyl-[(6-fluoroquinolin-8-yl)methyl]amino]ethanol
CID 102677075
2-[cyclopentyl(pyridin-4-ylmethyl)amino]ethanol
CID 62014276
2-[cyclobutyl-[[2-(propylamino)-3-pyridinyl]methyl]amino]ethanol
CID 102870532

Frequently Asked Questions

What is the IUPAC name of 2-[cyclobutyl(quinolin-4-ylmethyl)amino]ethanol?
The IUPAC name of 2-[cyclobutyl(quinolin-4-ylmethyl)amino]ethanol (CID 102679767) is 2-[cyclobutyl(quinolin-4-ylmethyl)amino]ethanol.
What is the SMILES notation for 2-[cyclobutyl(quinolin-4-ylmethyl)amino]ethanol?
The canonical SMILES for 2-[cyclobutyl(quinolin-4-ylmethyl)amino]ethanol is OCCN(Cc1ccnc2ccccc12)C1CCC1.
What is the InChIKey of 2-[cyclobutyl(quinolin-4-ylmethyl)amino]ethanol?
The InChIKey is BLSIULXPICMREY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c19-11-10-18(14-4-3-5-14)12-13-8-9-17-16-7-2-1-6-15(13)16/h1-2,6-9,14,19H,3-5,10-12H2.
What are the key properties of 2-[cyclobutyl(quinolin-4-ylmethyl)amino]ethanol?
2-[cyclobutyl(quinolin-4-ylmethyl)amino]ethanol has a molecular weight of 256.35 g/mol, XLogP of 2.58, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclobutyl(quinolin-4-ylmethyl)amino]ethanol is sourced from PubChem (CID 102679767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).