1-[2-hydroxyethyl(2-methoxyethyl)amino]-2-methylbutan-2-ol

C10H23NO3 — CID 114495810

IUPAC1-[2-hydroxyethyl(2-methoxyethyl)amino]-2-methylbutan-2-ol
SMILESCCC(C)(O)CN(CCO)CCOC
InChIInChI=1S/C10H23NO3/c1-4-10(2,13)9-11(5-7-12)6-8-14-3/h12-13H,4-9H2,1-3H3
InChIKeyKAVVKFJTQMLXQG-UHFFFAOYSA-N
MW205.30 g/mol
LogP0.09
Rot. Bonds8

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

1-[2-hydroxyethyl(2-methoxyethyl)amino]-2-methylbutan-2-ol (PubChem CID 114495810) has the molecular formula C10H23NO3 and a molecular weight of 205.30 g/mol. Its IUPAC name is 1-[2-hydroxyethyl(2-methoxyethyl)amino]-2-methylbutan-2-ol.

Molecular Properties

Compound Name1-[2-hydroxyethyl(2-methoxyethyl)amino]-2-methylbutan-2-ol
PubChem CID114495810
Molecular FormulaC10H23NO3
Molecular Weight205.30 g/mol
Exact Mass205.17
IUPAC Name1-[2-hydroxyethyl(2-methoxyethyl)amino]-2-methylbutan-2-ol
SMILESCCC(C)(O)CN(CCO)CCOC
InChIInChI=1S/C10H23NO3/c1-4-10(2,13)9-11(5-7-12)6-8-14-3/h12-13H,4-9H2,1-3H3
InChIKeyKAVVKFJTQMLXQG-UHFFFAOYSA-N
XLogP0.09
TPSA52.93 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 50.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[2-hydroxyethyl(2-methoxyethyl)amino]-2-methylbutan-2-ol?
The IUPAC name of 1-[2-hydroxyethyl(2-methoxyethyl)amino]-2-methylbutan-2-ol (CID 114495810) is 1-[2-hydroxyethyl(2-methoxyethyl)amino]-2-methylbutan-2-ol.
What is the SMILES notation for 1-[2-hydroxyethyl(2-methoxyethyl)amino]-2-methylbutan-2-ol?
The canonical SMILES for 1-[2-hydroxyethyl(2-methoxyethyl)amino]-2-methylbutan-2-ol is CCC(C)(O)CN(CCO)CCOC.
What is the InChIKey of 1-[2-hydroxyethyl(2-methoxyethyl)amino]-2-methylbutan-2-ol?
The InChIKey is KAVVKFJTQMLXQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO3/c1-4-10(2,13)9-11(5-7-12)6-8-14-3/h12-13H,4-9H2,1-3H3.
What are the key properties of 1-[2-hydroxyethyl(2-methoxyethyl)amino]-2-methylbutan-2-ol?
1-[2-hydroxyethyl(2-methoxyethyl)amino]-2-methylbutan-2-ol has a molecular weight of 205.30 g/mol, XLogP of 0.09, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-hydroxyethyl(2-methoxyethyl)amino]-2-methylbutan-2-ol is sourced from PubChem (CID 114495810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).