1-[2-hydroxyethyl(2-methylbutan-2-yl)amino]butan-2-ol

C11H25NO2 — CID 152540610

IUPAC1-[2-hydroxyethyl(2-methylbutan-2-yl)amino]butan-2-ol
SMILESCCC(O)CN(CCO)C(C)(C)CC
InChIInChI=1S/C11H25NO2/c1-5-10(14)9-12(7-8-13)11(3,4)6-2/h10,13-14H,5-9H2,1-4H3
InChIKeyYLLRZUFPAYPKCK-UHFFFAOYSA-N
MW203.33 g/mol
LogP1.24
Rot. Bonds7

About 1-[2-hydroxyethyl(2-methylbutan-2-yl)amino]butan-2-ol

1-[2-hydroxyethyl(2-methylbutan-2-yl)amino]butan-2-ol (PubChem CID 152540610) has the molecular formula C11H25NO2 and a molecular weight of 203.33 g/mol. Its IUPAC name is 1-[2-hydroxyethyl(2-methylbutan-2-yl)amino]butan-2-ol.

Molecular Properties

Compound Name1-[2-hydroxyethyl(2-methylbutan-2-yl)amino]butan-2-ol
PubChem CID152540610
Molecular FormulaC11H25NO2
Molecular Weight203.33 g/mol
Exact Mass203.19
IUPAC Name1-[2-hydroxyethyl(2-methylbutan-2-yl)amino]butan-2-ol
SMILESCCC(O)CN(CCO)C(C)(C)CC
InChIInChI=1S/C11H25NO2/c1-5-10(14)9-12(7-8-13)11(3,4)6-2/h10,13-14H,5-9H2,1-4H3
InChIKeyYLLRZUFPAYPKCK-UHFFFAOYSA-N
XLogP1.24
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-[2-hydroxyethyl(2-methylbutan-2-yl)amino]butan-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[2-hydroxyethyl(2-methylbutan-2-yl)amino]butan-2-ol?
The IUPAC name of 1-[2-hydroxyethyl(2-methylbutan-2-yl)amino]butan-2-ol (CID 152540610) is 1-[2-hydroxyethyl(2-methylbutan-2-yl)amino]butan-2-ol.
What is the SMILES notation for 1-[2-hydroxyethyl(2-methylbutan-2-yl)amino]butan-2-ol?
The canonical SMILES for 1-[2-hydroxyethyl(2-methylbutan-2-yl)amino]butan-2-ol is CCC(O)CN(CCO)C(C)(C)CC.
What is the InChIKey of 1-[2-hydroxyethyl(2-methylbutan-2-yl)amino]butan-2-ol?
The InChIKey is YLLRZUFPAYPKCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO2/c1-5-10(14)9-12(7-8-13)11(3,4)6-2/h10,13-14H,5-9H2,1-4H3.
What are the key properties of 1-[2-hydroxyethyl(2-methylbutan-2-yl)amino]butan-2-ol?
1-[2-hydroxyethyl(2-methylbutan-2-yl)amino]butan-2-ol has a molecular weight of 203.33 g/mol, XLogP of 1.24, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-hydroxyethyl(2-methylbutan-2-yl)amino]butan-2-ol is sourced from PubChem (CID 152540610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).