2-[3-(2-hydroxyethylamino)-2-methylanilino]ethanol

C11H18N2O2 — CID 10130524

IUPAC2-[3-(2-hydroxyethylamino)-2-methylanilino]ethanol
SMILESCc1c(NCCO)cccc1NCCO
InChIInChI=1S/C11H18N2O2/c1-9-10(12-5-7-14)3-2-4-11(9)13-6-8-15/h2-4,12-15H,5-8H2,1H3
InChIKeyFGYCMSFOZIRDLN-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.80
Rot. Bonds6

About 2-[3-(2-hydroxyethylamino)-2-methylanilino]ethanol

2-[3-(2-hydroxyethylamino)-2-methylanilino]ethanol (PubChem CID 10130524) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is 2-[3-(2-hydroxyethylamino)-2-methylanilino]ethanol.

Molecular Properties

Compound Name2-[3-(2-hydroxyethylamino)-2-methylanilino]ethanol
PubChem CID10130524
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC Name2-[3-(2-hydroxyethylamino)-2-methylanilino]ethanol
SMILESCc1c(NCCO)cccc1NCCO
InChIInChI=1S/C11H18N2O2/c1-9-10(12-5-7-14)3-2-4-11(9)13-6-8-15/h2-4,12-15H,5-8H2,1H3
InChIKeyFGYCMSFOZIRDLN-UHFFFAOYSA-N
XLogP0.80
TPSA64.52 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.80
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[3-(2-hydroxyethylamino)-2-methylanilino]ethanol?
The IUPAC name of 2-[3-(2-hydroxyethylamino)-2-methylanilino]ethanol (CID 10130524) is 2-[3-(2-hydroxyethylamino)-2-methylanilino]ethanol.
What is the SMILES notation for 2-[3-(2-hydroxyethylamino)-2-methylanilino]ethanol?
The canonical SMILES for 2-[3-(2-hydroxyethylamino)-2-methylanilino]ethanol is Cc1c(NCCO)cccc1NCCO.
What is the InChIKey of 2-[3-(2-hydroxyethylamino)-2-methylanilino]ethanol?
The InChIKey is FGYCMSFOZIRDLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-9-10(12-5-7-14)3-2-4-11(9)13-6-8-15/h2-4,12-15H,5-8H2,1H3.
What are the key properties of 2-[3-(2-hydroxyethylamino)-2-methylanilino]ethanol?
2-[3-(2-hydroxyethylamino)-2-methylanilino]ethanol has a molecular weight of 210.28 g/mol, XLogP of 0.80, 6 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(2-hydroxyethylamino)-2-methylanilino]ethanol is sourced from PubChem (CID 10130524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).