(3R)-3-hydroxy-N,N,4,4-tetramethylpentanamide

C9H19NO2 — CID 13197450

IUPAC(3R)-3-hydroxy-N,N,4,4-tetramethylpentanamide
SMILESCN(C)C(=O)C[C@@H](O)C(C)(C)C
InChIInChI=1S/C9H19NO2/c1-9(2,3)7(11)6-8(12)10(4)5/h7,11H,6H2,1-5H3/t7-/m1/s1
InChIKeyHAUWRDZJRCZVGT-SSDOTTSWSA-N
MW173.26 g/mol
LogP0.87
Rot. Bonds2

About (3R)-3-hydroxy-N,N,4,4-tetramethylpentanamide

(3R)-3-hydroxy-N,N,4,4-tetramethylpentanamide (PubChem CID 13197450) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is (3R)-3-hydroxy-N,N,4,4-tetramethylpentanamide.

Molecular Properties

Compound Name(3R)-3-hydroxy-N,N,4,4-tetramethylpentanamide
PubChem CID13197450
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC Name(3R)-3-hydroxy-N,N,4,4-tetramethylpentanamide
SMILESCN(C)C(=O)C[C@@H](O)C(C)(C)C
InChIInChI=1S/C9H19NO2/c1-9(2,3)7(11)6-8(12)10(4)5/h7,11H,6H2,1-5H3/t7-/m1/s1
InChIKeyHAUWRDZJRCZVGT-SSDOTTSWSA-N
XLogP0.87
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3R)-3-hydroxy-N,N,4,4-tetramethylpentanamide?
The IUPAC name of (3R)-3-hydroxy-N,N,4,4-tetramethylpentanamide (CID 13197450) is (3R)-3-hydroxy-N,N,4,4-tetramethylpentanamide.
What is the SMILES notation for (3R)-3-hydroxy-N,N,4,4-tetramethylpentanamide?
The canonical SMILES for (3R)-3-hydroxy-N,N,4,4-tetramethylpentanamide is CN(C)C(=O)C[C@@H](O)C(C)(C)C.
What is the InChIKey of (3R)-3-hydroxy-N,N,4,4-tetramethylpentanamide?
The InChIKey is HAUWRDZJRCZVGT-SSDOTTSWSA-N. The full InChI is InChI=1S/C9H19NO2/c1-9(2,3)7(11)6-8(12)10(4)5/h7,11H,6H2,1-5H3/t7-/m1/s1.
What are the key properties of (3R)-3-hydroxy-N,N,4,4-tetramethylpentanamide?
(3R)-3-hydroxy-N,N,4,4-tetramethylpentanamide has a molecular weight of 173.26 g/mol, XLogP of 0.87, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-hydroxy-N,N,4,4-tetramethylpentanamide is sourced from PubChem (CID 13197450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).