2-[benzhydryl(ethyl)amino]ethanol

C17H21NO — CID 131843300

IUPAC2-[benzhydryl(ethyl)amino]ethanol
SMILESCCN(CCO)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C17H21NO/c1-2-18(13-14-19)17(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12,17,19H,2,13-14H2,1H3
InChIKeyQNULSQIHMCVWJD-UHFFFAOYSA-N
MW255.36 g/mol
LogP3.09
Rot. Bonds6

About 2-[benzhydryl(ethyl)amino]ethanol

2-[benzhydryl(ethyl)amino]ethanol (PubChem CID 131843300) has the molecular formula C17H21NO and a molecular weight of 255.36 g/mol. Its IUPAC name is 2-[benzhydryl(ethyl)amino]ethanol.

Molecular Properties

Compound Name2-[benzhydryl(ethyl)amino]ethanol
PubChem CID131843300
Molecular FormulaC17H21NO
Molecular Weight255.36 g/mol
Exact Mass255.16
IUPAC Name2-[benzhydryl(ethyl)amino]ethanol
SMILESCCN(CCO)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C17H21NO/c1-2-18(13-14-19)17(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12,17,19H,2,13-14H2,1H3
InChIKeyQNULSQIHMCVWJD-UHFFFAOYSA-N
XLogP3.09
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[benzhydryl(ethyl)amino]ethanol?
The IUPAC name of 2-[benzhydryl(ethyl)amino]ethanol (CID 131843300) is 2-[benzhydryl(ethyl)amino]ethanol.
What is the SMILES notation for 2-[benzhydryl(ethyl)amino]ethanol?
The canonical SMILES for 2-[benzhydryl(ethyl)amino]ethanol is CCN(CCO)C(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-[benzhydryl(ethyl)amino]ethanol?
The InChIKey is QNULSQIHMCVWJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO/c1-2-18(13-14-19)17(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12,17,19H,2,13-14H2,1H3.
What are the key properties of 2-[benzhydryl(ethyl)amino]ethanol?
2-[benzhydryl(ethyl)amino]ethanol has a molecular weight of 255.36 g/mol, XLogP of 3.09, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[benzhydryl(ethyl)amino]ethanol is sourced from PubChem (CID 131843300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).