3-(2-hydroxyethylamino)-2,3-dimethylbutan-2-ol

C8H19NO2 — CID 103911892

IUPAC3-(2-hydroxyethylamino)-2,3-dimethylbutan-2-ol
SMILESCC(C)(O)C(C)(C)NCCO
InChIInChI=1S/C8H19NO2/c1-7(2,8(3,4)11)9-5-6-10/h9-11H,5-6H2,1-4H3
InChIKeyWWBVVFCCBWDDCF-UHFFFAOYSA-N
MW161.24 g/mol
LogP0.12
Rot. Bonds4

About 3-(2-hydroxyethylamino)-2,3-dimethylbutan-2-ol

3-(2-hydroxyethylamino)-2,3-dimethylbutan-2-ol (PubChem CID 103911892) has the molecular formula C8H19NO2 and a molecular weight of 161.24 g/mol. Its IUPAC name is 3-(2-hydroxyethylamino)-2,3-dimethylbutan-2-ol.

Molecular Properties

Compound Name3-(2-hydroxyethylamino)-2,3-dimethylbutan-2-ol
PubChem CID103911892
Molecular FormulaC8H19NO2
Molecular Weight161.24 g/mol
Exact Mass161.14
IUPAC Name3-(2-hydroxyethylamino)-2,3-dimethylbutan-2-ol
SMILESCC(C)(O)C(C)(C)NCCO
InChIInChI=1S/C8H19NO2/c1-7(2,8(3,4)11)9-5-6-10/h9-11H,5-6H2,1-4H3
InChIKeyWWBVVFCCBWDDCF-UHFFFAOYSA-N
XLogP0.12
TPSA52.49 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.24
LogP ≤ 50.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(2-hydroxyethylamino)-2,3-dimethylbutan-2-ol?
The IUPAC name of 3-(2-hydroxyethylamino)-2,3-dimethylbutan-2-ol (CID 103911892) is 3-(2-hydroxyethylamino)-2,3-dimethylbutan-2-ol.
What is the SMILES notation for 3-(2-hydroxyethylamino)-2,3-dimethylbutan-2-ol?
The canonical SMILES for 3-(2-hydroxyethylamino)-2,3-dimethylbutan-2-ol is CC(C)(O)C(C)(C)NCCO.
What is the InChIKey of 3-(2-hydroxyethylamino)-2,3-dimethylbutan-2-ol?
The InChIKey is WWBVVFCCBWDDCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO2/c1-7(2,8(3,4)11)9-5-6-10/h9-11H,5-6H2,1-4H3.
What are the key properties of 3-(2-hydroxyethylamino)-2,3-dimethylbutan-2-ol?
3-(2-hydroxyethylamino)-2,3-dimethylbutan-2-ol has a molecular weight of 161.24 g/mol, XLogP of 0.12, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-hydroxyethylamino)-2,3-dimethylbutan-2-ol is sourced from PubChem (CID 103911892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).