3-[2-(ethylamino)-1-hydroxyethyl]phenol

C10H15NO2 — CID 3306

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IUPAC3-[2-(ethylamino)-1-hydroxyethyl]phenol
SMILESCCNCC(O)c1cccc(O)c1
InChIInChI=1S/C10H15NO2/c1-2-11-7-10(13)8-4-3-5-9(12)6-8/h3-6,10-13H,2,7H2,1H3
InChIKeySQVIAVUSQAWMKL-UHFFFAOYSA-N
MW181.24 g/mol
LogP1.04
Rot. Bonds4

About 3-[2-(ethylamino)-1-hydroxyethyl]phenol

3-[2-(ethylamino)-1-hydroxyethyl]phenol (PubChem CID 3306) has the molecular formula C10H15NO2 and a molecular weight of 181.24 g/mol. Its IUPAC name is 3-[2-(ethylamino)-1-hydroxyethyl]phenol.

Molecular Properties

Compound Name3-[2-(ethylamino)-1-hydroxyethyl]phenol
PubChem CID3306
Molecular FormulaC10H15NO2
Molecular Weight181.24 g/mol
Exact Mass181.11
IUPAC Name3-[2-(ethylamino)-1-hydroxyethyl]phenol
SMILESCCNCC(O)c1cccc(O)c1
InChIInChI=1S/C10H15NO2/c1-2-11-7-10(13)8-4-3-5-9(12)6-8/h3-6,10-13H,2,7H2,1H3
InChIKeySQVIAVUSQAWMKL-UHFFFAOYSA-N
XLogP1.04
TPSA52.49 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 51.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[2-(ethylamino)-1-hydroxyethyl]phenol?
The IUPAC name of 3-[2-(ethylamino)-1-hydroxyethyl]phenol (CID 3306) is 3-[2-(ethylamino)-1-hydroxyethyl]phenol.
What is the SMILES notation for 3-[2-(ethylamino)-1-hydroxyethyl]phenol?
The canonical SMILES for 3-[2-(ethylamino)-1-hydroxyethyl]phenol is CCNCC(O)c1cccc(O)c1.
What is the InChIKey of 3-[2-(ethylamino)-1-hydroxyethyl]phenol?
The InChIKey is SQVIAVUSQAWMKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2/c1-2-11-7-10(13)8-4-3-5-9(12)6-8/h3-6,10-13H,2,7H2,1H3.
What are the key properties of 3-[2-(ethylamino)-1-hydroxyethyl]phenol?
3-[2-(ethylamino)-1-hydroxyethyl]phenol has a molecular weight of 181.24 g/mol, XLogP of 1.04, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(ethylamino)-1-hydroxyethyl]phenol is sourced from PubChem (CID 3306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).