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

C7H15NO2 — CID 58080124

IUPAC(3R)-4-hydroxy-N,N,3-trimethylbutanamide
SMILESC[C@@H](CO)CC(=O)N(C)C
InChIInChI=1S/C7H15NO2/c1-6(5-9)4-7(10)8(2)3/h6,9H,4-5H2,1-3H3/t6-/m1/s1
InChIKeyZXUPESYOVWTLSM-ZCFIWIBFSA-N
MW145.20 g/mol
LogP0.09
Rot. Bonds3

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

(3R)-4-hydroxy-N,N,3-trimethylbutanamide (PubChem CID 58080124) has the molecular formula C7H15NO2 and a molecular weight of 145.20 g/mol. Its IUPAC name is (3R)-4-hydroxy-N,N,3-trimethylbutanamide.

Molecular Properties

Compound Name(3R)-4-hydroxy-N,N,3-trimethylbutanamide
PubChem CID58080124
Molecular FormulaC7H15NO2
Molecular Weight145.20 g/mol
Exact Mass145.11
IUPAC Name(3R)-4-hydroxy-N,N,3-trimethylbutanamide
SMILESC[C@@H](CO)CC(=O)N(C)C
InChIInChI=1S/C7H15NO2/c1-6(5-9)4-7(10)8(2)3/h6,9H,4-5H2,1-3H3/t6-/m1/s1
InChIKeyZXUPESYOVWTLSM-ZCFIWIBFSA-N
XLogP0.09
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 50.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3R)-4-hydroxy-N,N,3-trimethylbutanamide?
The IUPAC name of (3R)-4-hydroxy-N,N,3-trimethylbutanamide (CID 58080124) is (3R)-4-hydroxy-N,N,3-trimethylbutanamide.
What is the SMILES notation for (3R)-4-hydroxy-N,N,3-trimethylbutanamide?
The canonical SMILES for (3R)-4-hydroxy-N,N,3-trimethylbutanamide is C[C@@H](CO)CC(=O)N(C)C.
What is the InChIKey of (3R)-4-hydroxy-N,N,3-trimethylbutanamide?
The InChIKey is ZXUPESYOVWTLSM-ZCFIWIBFSA-N. The full InChI is InChI=1S/C7H15NO2/c1-6(5-9)4-7(10)8(2)3/h6,9H,4-5H2,1-3H3/t6-/m1/s1.
What are the key properties of (3R)-4-hydroxy-N,N,3-trimethylbutanamide?
(3R)-4-hydroxy-N,N,3-trimethylbutanamide has a molecular weight of 145.20 g/mol, XLogP of 0.09, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-4-hydroxy-N,N,3-trimethylbutanamide is sourced from PubChem (CID 58080124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).