2-(diethylamino)-2-phenylethanol

C12H19NO — CID 13119689

IUPAC2-(diethylamino)-2-phenylethanol
SMILESCCN(CC)C(CO)c1ccccc1
InChIInChI=1S/C12H19NO/c1-3-13(4-2)12(10-14)11-8-6-5-7-9-11/h5-9,12,14H,3-4,10H2,1-2H3
InChIKeyJTFMGXYUGTZOAX-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.06
Rot. Bonds5

About 2-(diethylamino)-2-phenylethanol

2-(diethylamino)-2-phenylethanol (PubChem CID 13119689) has the molecular formula C12H19NO and a molecular weight of 193.29 g/mol. Its IUPAC name is 2-(diethylamino)-2-phenylethanol.

Molecular Properties

Compound Name2-(diethylamino)-2-phenylethanol
PubChem CID13119689
Molecular FormulaC12H19NO
Molecular Weight193.29 g/mol
Exact Mass193.15
IUPAC Name2-(diethylamino)-2-phenylethanol
SMILESCCN(CC)C(CO)c1ccccc1
InChIInChI=1S/C12H19NO/c1-3-13(4-2)12(10-14)11-8-6-5-7-9-11/h5-9,12,14H,3-4,10H2,1-2H3
InChIKeyJTFMGXYUGTZOAX-UHFFFAOYSA-N
XLogP2.06
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 14909
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CID 7059596
Etafedrine
CID 94532
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N-Benzyl-N-methylethanolamine
CID 66876
2-[2-Hydroxyethyl-[(4-methylphenyl)methyl]amino]ethanol
CID 4219208
Etafedrine Hydrochloride
CID 76964725

Frequently Asked Questions

What is the IUPAC name of 2-(diethylamino)-2-phenylethanol?
The IUPAC name of 2-(diethylamino)-2-phenylethanol (CID 13119689) is 2-(diethylamino)-2-phenylethanol.
What is the SMILES notation for 2-(diethylamino)-2-phenylethanol?
The canonical SMILES for 2-(diethylamino)-2-phenylethanol is CCN(CC)C(CO)c1ccccc1.
What is the InChIKey of 2-(diethylamino)-2-phenylethanol?
The InChIKey is JTFMGXYUGTZOAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO/c1-3-13(4-2)12(10-14)11-8-6-5-7-9-11/h5-9,12,14H,3-4,10H2,1-2H3.
What are the key properties of 2-(diethylamino)-2-phenylethanol?
2-(diethylamino)-2-phenylethanol has a molecular weight of 193.29 g/mol, XLogP of 2.06, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(diethylamino)-2-phenylethanol is sourced from PubChem (CID 13119689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).