2-[2-hydroxyethyl(methyl)amino]-1-phenylethanol

C11H17NO2 — CID 4668919

IUPAC2-[2-hydroxyethyl(methyl)amino]-1-phenylethanol
SMILESCN(CCO)CC(O)c1ccccc1
InChIInChI=1S/C11H17NO2/c1-12(7-8-13)9-11(14)10-5-3-2-4-6-10/h2-6,11,13-14H,7-9H2,1H3
InChIKeyDTYODHRLIDBIOC-UHFFFAOYSA-N
MW195.26 g/mol
LogP0.64
Rot. Bonds5

About 2-[2-hydroxyethyl(methyl)amino]-1-phenylethanol

2-[2-hydroxyethyl(methyl)amino]-1-phenylethanol (PubChem CID 4668919) has the molecular formula C11H17NO2 and a molecular weight of 195.26 g/mol. Its IUPAC name is 2-[2-hydroxyethyl(methyl)amino]-1-phenylethanol.

Molecular Properties

Compound Name2-[2-hydroxyethyl(methyl)amino]-1-phenylethanol
PubChem CID4668919
Molecular FormulaC11H17NO2
Molecular Weight195.26 g/mol
Exact Mass195.13
IUPAC Name2-[2-hydroxyethyl(methyl)amino]-1-phenylethanol
SMILESCN(CCO)CC(O)c1ccccc1
InChIInChI=1S/C11H17NO2/c1-12(7-8-13)9-11(14)10-5-3-2-4-6-10/h2-6,11,13-14H,7-9H2,1H3
InChIKeyDTYODHRLIDBIOC-UHFFFAOYSA-N
XLogP0.64
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 50.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[2-hydroxyethyl(methyl)amino]-1-phenylethanol?
The IUPAC name of 2-[2-hydroxyethyl(methyl)amino]-1-phenylethanol (CID 4668919) is 2-[2-hydroxyethyl(methyl)amino]-1-phenylethanol.
What is the SMILES notation for 2-[2-hydroxyethyl(methyl)amino]-1-phenylethanol?
The canonical SMILES for 2-[2-hydroxyethyl(methyl)amino]-1-phenylethanol is CN(CCO)CC(O)c1ccccc1.
What is the InChIKey of 2-[2-hydroxyethyl(methyl)amino]-1-phenylethanol?
The InChIKey is DTYODHRLIDBIOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2/c1-12(7-8-13)9-11(14)10-5-3-2-4-6-10/h2-6,11,13-14H,7-9H2,1H3.
What are the key properties of 2-[2-hydroxyethyl(methyl)amino]-1-phenylethanol?
2-[2-hydroxyethyl(methyl)amino]-1-phenylethanol has a molecular weight of 195.26 g/mol, XLogP of 0.64, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-hydroxyethyl(methyl)amino]-1-phenylethanol is sourced from PubChem (CID 4668919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).