N-(2-hydroxyethyl)-2,3-dimethyl-2-propan-2-ylbutanamide

C11H23NO2 — CID 22182807

IUPACN-(2-hydroxyethyl)-2,3-dimethyl-2-propan-2-ylbutanamide
SMILESCC(C)C(C)(C(=O)NCCO)C(C)C
InChIInChI=1S/C11H23NO2/c1-8(2)11(5,9(3)4)10(14)12-6-7-13/h8-9,13H,6-7H2,1-5H3,(H,12,14)
InChIKeyCUNIMRNZTKYNGN-UHFFFAOYSA-N
MW201.31 g/mol
LogP1.41
Rot. Bonds5

About N-(2-hydroxyethyl)-2,3-dimethyl-2-propan-2-ylbutanamide

N-(2-hydroxyethyl)-2,3-dimethyl-2-propan-2-ylbutanamide (PubChem CID 22182807) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-2,3-dimethyl-2-propan-2-ylbutanamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-2,3-dimethyl-2-propan-2-ylbutanamide
PubChem CID22182807
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC NameN-(2-hydroxyethyl)-2,3-dimethyl-2-propan-2-ylbutanamide
SMILESCC(C)C(C)(C(=O)NCCO)C(C)C
InChIInChI=1S/C11H23NO2/c1-8(2)11(5,9(3)4)10(14)12-6-7-13/h8-9,13H,6-7H2,1-5H3,(H,12,14)
InChIKeyCUNIMRNZTKYNGN-UHFFFAOYSA-N
XLogP1.41
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-2,3-dimethyl-2-propan-2-ylbutanamide?
The IUPAC name of N-(2-hydroxyethyl)-2,3-dimethyl-2-propan-2-ylbutanamide (CID 22182807) is N-(2-hydroxyethyl)-2,3-dimethyl-2-propan-2-ylbutanamide.
What is the SMILES notation for N-(2-hydroxyethyl)-2,3-dimethyl-2-propan-2-ylbutanamide?
The canonical SMILES for N-(2-hydroxyethyl)-2,3-dimethyl-2-propan-2-ylbutanamide is CC(C)C(C)(C(=O)NCCO)C(C)C.
What is the InChIKey of N-(2-hydroxyethyl)-2,3-dimethyl-2-propan-2-ylbutanamide?
The InChIKey is CUNIMRNZTKYNGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c1-8(2)11(5,9(3)4)10(14)12-6-7-13/h8-9,13H,6-7H2,1-5H3,(H,12,14).
What are the key properties of N-(2-hydroxyethyl)-2,3-dimethyl-2-propan-2-ylbutanamide?
N-(2-hydroxyethyl)-2,3-dimethyl-2-propan-2-ylbutanamide has a molecular weight of 201.31 g/mol, XLogP of 1.41, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-2,3-dimethyl-2-propan-2-ylbutanamide is sourced from PubChem (CID 22182807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).