2-[benzyl(2-pyridin-4-ylethyl)amino]ethanol

C16H20N2O — CID 60649363

IUPAC2-[benzyl(2-pyridin-4-ylethyl)amino]ethanol
SMILESOCCN(CCc1ccncc1)Cc1ccccc1
InChIInChI=1S/C16H20N2O/c19-13-12-18(14-16-4-2-1-3-5-16)11-8-15-6-9-17-10-7-15/h1-7,9-10,19H,8,11-14H2
InChIKeyMGKDNCALOGEGFM-UHFFFAOYSA-N
MW256.35 g/mol
LogP2.12
Rot. Bonds7

About 2-[benzyl(2-pyridin-4-ylethyl)amino]ethanol

2-[benzyl(2-pyridin-4-ylethyl)amino]ethanol (PubChem CID 60649363) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is 2-[benzyl(2-pyridin-4-ylethyl)amino]ethanol.

Molecular Properties

Compound Name2-[benzyl(2-pyridin-4-ylethyl)amino]ethanol
PubChem CID60649363
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC Name2-[benzyl(2-pyridin-4-ylethyl)amino]ethanol
SMILESOCCN(CCc1ccncc1)Cc1ccccc1
InChIInChI=1S/C16H20N2O/c19-13-12-18(14-16-4-2-1-3-5-16)11-8-15-6-9-17-10-7-15/h1-7,9-10,19H,8,11-14H2
InChIKeyMGKDNCALOGEGFM-UHFFFAOYSA-N
XLogP2.12
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(4-bromophenyl)methyl-(2-phenylethyl)amino]ethanol
CID 86942997
N-[[4-[[bis(2-phenylethyl)amino]methyl]phenyl]methyl]-2-phenyl-N-(2-phenylethyl)ethanamine
CID 59482591
2-[benzyl(4-phenylbutyl)amino]ethanol
CID 114334509
N-methyl-2-phenyl-N-(pyridin-4-ylmethyl)ethanamine
CID 3817841
N-benzyl-N-methyl-2-pyridin-4-ylethanamine
CID 78793254
2-[benzyl(2-fluoroethyl)amino]ethanol
CID 80601443
2-[(3-methylimidazol-4-yl)methyl-(2-phenylethyl)amino]ethanol
CID 135120617
3-[benzyl(2-hydroxyethyl)amino]propanoic acid
CID 43841843
2-amino-2-(hydroxymethyl)propane-1,3-diol;2-[benzyl(2-hydroxyethyl)amino]ethanol
CID 158603014
3-[benzyl(2-hydroxyethyl)amino]-1-pyrimidin-4-ylpropan-1-one
CID 46231612
2-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl-(2-phenylethyl)amino]ethanol
CID 111121817
N'-benzyl-N,N'-dimethyl-N-(2-pyridin-4-ylethyl)oxamide
CID 108984872

Frequently Asked Questions

What is the IUPAC name of 2-[benzyl(2-pyridin-4-ylethyl)amino]ethanol?
The IUPAC name of 2-[benzyl(2-pyridin-4-ylethyl)amino]ethanol (CID 60649363) is 2-[benzyl(2-pyridin-4-ylethyl)amino]ethanol.
What is the SMILES notation for 2-[benzyl(2-pyridin-4-ylethyl)amino]ethanol?
The canonical SMILES for 2-[benzyl(2-pyridin-4-ylethyl)amino]ethanol is OCCN(CCc1ccncc1)Cc1ccccc1.
What is the InChIKey of 2-[benzyl(2-pyridin-4-ylethyl)amino]ethanol?
The InChIKey is MGKDNCALOGEGFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c19-13-12-18(14-16-4-2-1-3-5-16)11-8-15-6-9-17-10-7-15/h1-7,9-10,19H,8,11-14H2.
What are the key properties of 2-[benzyl(2-pyridin-4-ylethyl)amino]ethanol?
2-[benzyl(2-pyridin-4-ylethyl)amino]ethanol has a molecular weight of 256.35 g/mol, XLogP of 2.12, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[benzyl(2-pyridin-4-ylethyl)amino]ethanol is sourced from PubChem (CID 60649363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).