(2S)-4-amino-2-hydroxy-N,N-dimethylbutanamide

C6H14N2O2 — CID 87476132

IUPAC(2S)-4-amino-2-hydroxy-N,N-dimethylbutanamide
SMILESCN(C)C(=O)[C@@H](O)CCN
InChIInChI=1S/C6H14N2O2/c1-8(2)6(10)5(9)3-4-7/h5,9H,3-4,7H2,1-2H3/t5-/m0/s1
InChIKeySPTCHGNJANDKBK-YFKPBYRVSA-N
MW146.19 g/mol
LogP-1.22
Rot. Bonds3

About (2S)-4-amino-2-hydroxy-N,N-dimethylbutanamide

(2S)-4-amino-2-hydroxy-N,N-dimethylbutanamide (PubChem CID 87476132) has the molecular formula C6H14N2O2 and a molecular weight of 146.19 g/mol. Its IUPAC name is (2S)-4-amino-2-hydroxy-N,N-dimethylbutanamide.

Molecular Properties

Compound Name(2S)-4-amino-2-hydroxy-N,N-dimethylbutanamide
PubChem CID87476132
Molecular FormulaC6H14N2O2
Molecular Weight146.19 g/mol
Exact Mass146.11
IUPAC Name(2S)-4-amino-2-hydroxy-N,N-dimethylbutanamide
SMILESCN(C)C(=O)[C@@H](O)CCN
InChIInChI=1S/C6H14N2O2/c1-8(2)6(10)5(9)3-4-7/h5,9H,3-4,7H2,1-2H3/t5-/m0/s1
InChIKeySPTCHGNJANDKBK-YFKPBYRVSA-N
XLogP-1.22
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 5-1.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2S)-4-amino-2-hydroxy-N,N-dimethylbutanamide?
The IUPAC name of (2S)-4-amino-2-hydroxy-N,N-dimethylbutanamide (CID 87476132) is (2S)-4-amino-2-hydroxy-N,N-dimethylbutanamide.
What is the SMILES notation for (2S)-4-amino-2-hydroxy-N,N-dimethylbutanamide?
The canonical SMILES for (2S)-4-amino-2-hydroxy-N,N-dimethylbutanamide is CN(C)C(=O)[C@@H](O)CCN.
What is the InChIKey of (2S)-4-amino-2-hydroxy-N,N-dimethylbutanamide?
The InChIKey is SPTCHGNJANDKBK-YFKPBYRVSA-N. The full InChI is InChI=1S/C6H14N2O2/c1-8(2)6(10)5(9)3-4-7/h5,9H,3-4,7H2,1-2H3/t5-/m0/s1.
What are the key properties of (2S)-4-amino-2-hydroxy-N,N-dimethylbutanamide?
(2S)-4-amino-2-hydroxy-N,N-dimethylbutanamide has a molecular weight of 146.19 g/mol, XLogP of -1.22, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-4-amino-2-hydroxy-N,N-dimethylbutanamide is sourced from PubChem (CID 87476132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).