2-[2-[benzyl(methyl)amino]ethyl]phenol

C16H19NO — CID 70480829

IUPAC2-[2-[benzyl(methyl)amino]ethyl]phenol
SMILESCN(CCc1ccccc1O)Cc1ccccc1
InChIInChI=1S/C16H19NO/c1-17(13-14-7-3-2-4-8-14)12-11-15-9-5-6-10-16(15)18/h2-10,18H,11-13H2,1H3
InChIKeyGEHFKRYTMNHOAE-UHFFFAOYSA-N
MW241.33 g/mol
LogP3.07
Rot. Bonds5

About 2-[2-[benzyl(methyl)amino]ethyl]phenol

2-[2-[benzyl(methyl)amino]ethyl]phenol (PubChem CID 70480829) has the molecular formula C16H19NO and a molecular weight of 241.33 g/mol. Its IUPAC name is 2-[2-[benzyl(methyl)amino]ethyl]phenol.

Molecular Properties

Compound Name2-[2-[benzyl(methyl)amino]ethyl]phenol
PubChem CID70480829
Molecular FormulaC16H19NO
Molecular Weight241.33 g/mol
Exact Mass241.15
IUPAC Name2-[2-[benzyl(methyl)amino]ethyl]phenol
SMILESCN(CCc1ccccc1O)Cc1ccccc1
InChIInChI=1S/C16H19NO/c1-17(13-14-7-3-2-4-8-14)12-11-15-9-5-6-10-16(15)18/h2-10,18H,11-13H2,1H3
InChIKeyGEHFKRYTMNHOAE-UHFFFAOYSA-N
XLogP3.07
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[benzyl(methyl)amino]-N-[(2-hydroxyphenyl)methyl]-N-methylacetamide
CID 86861731
N-benzyl-N-methyl-1-phenylmethanamine;oxalic acid
CID 163328136
N-methyl-2-phenyl-N-(pyridin-4-ylmethyl)ethanamine
CID 3817841
N-benzyl-N-methyl-2-pyridin-4-ylethanamine
CID 78793254
2-[[benzyl-[2-(dimethylamino)ethyl]amino]methyl]phenol;oxalic acid
CID 126468036
[2-[[methyl(2-phenylethyl)amino]methyl]phenyl]boronic acid
CID 65488036
2-[[methyl(2-phenylethyl)amino]methyl]benzoic acid
CID 65486668
4-[4-[benzyl(methyl)amino]butyl]phenol
CID 82188000
N'-benzyl-N'-methylethane-1,2-diamine
CID 3014812
2-[2-[(3-fluorophenyl)methyl-methylamino]ethyl]benzoic acid
CID 104548693
2-[[methyl(2-phenylethyl)amino]methyl]aniline
CID 23507547
2-[benzyl(methyl)amino]-N-(2-phenylethyl)acetamide
CID 54808729

Frequently Asked Questions

What is the IUPAC name of 2-[2-[benzyl(methyl)amino]ethyl]phenol?
The IUPAC name of 2-[2-[benzyl(methyl)amino]ethyl]phenol (CID 70480829) is 2-[2-[benzyl(methyl)amino]ethyl]phenol.
What is the SMILES notation for 2-[2-[benzyl(methyl)amino]ethyl]phenol?
The canonical SMILES for 2-[2-[benzyl(methyl)amino]ethyl]phenol is CN(CCc1ccccc1O)Cc1ccccc1.
What is the InChIKey of 2-[2-[benzyl(methyl)amino]ethyl]phenol?
The InChIKey is GEHFKRYTMNHOAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO/c1-17(13-14-7-3-2-4-8-14)12-11-15-9-5-6-10-16(15)18/h2-10,18H,11-13H2,1H3.
What are the key properties of 2-[2-[benzyl(methyl)amino]ethyl]phenol?
2-[2-[benzyl(methyl)amino]ethyl]phenol has a molecular weight of 241.33 g/mol, XLogP of 3.07, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[benzyl(methyl)amino]ethyl]phenol is sourced from PubChem (CID 70480829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).