(2S)-2-amino-N,N-diethyl-3,3-dimethylbutanamide

C10H22N2O — CID 25067345

IUPAC(2S)-2-amino-N,N-diethyl-3,3-dimethylbutanamide
SMILESCCN(CC)C(=O)[C@@H](N)C(C)(C)C
InChIInChI=1S/C10H22N2O/c1-6-12(7-2)9(13)8(11)10(3,4)5/h8H,6-7,11H2,1-5H3/t8-/m1/s1
InChIKeyWAHPTCKZJXPLKY-MRVPVSSYSA-N
MW186.30 g/mol
LogP1.23
Rot. Bonds3

About (2S)-2-amino-N,N-diethyl-3,3-dimethylbutanamide

(2S)-2-amino-N,N-diethyl-3,3-dimethylbutanamide (PubChem CID 25067345) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is (2S)-2-amino-N,N-diethyl-3,3-dimethylbutanamide.

Molecular Properties

Compound Name(2S)-2-amino-N,N-diethyl-3,3-dimethylbutanamide
PubChem CID25067345
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Name(2S)-2-amino-N,N-diethyl-3,3-dimethylbutanamide
SMILESCCN(CC)C(=O)[C@@H](N)C(C)(C)C
InChIInChI=1S/C10H22N2O/c1-6-12(7-2)9(13)8(11)10(3,4)5/h8H,6-7,11H2,1-5H3/t8-/m1/s1
InChIKeyWAHPTCKZJXPLKY-MRVPVSSYSA-N
XLogP1.23
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N,N-diethyl-3,3-dimethylbutanamide?
The IUPAC name of (2S)-2-amino-N,N-diethyl-3,3-dimethylbutanamide (CID 25067345) is (2S)-2-amino-N,N-diethyl-3,3-dimethylbutanamide.
What is the SMILES notation for (2S)-2-amino-N,N-diethyl-3,3-dimethylbutanamide?
The canonical SMILES for (2S)-2-amino-N,N-diethyl-3,3-dimethylbutanamide is CCN(CC)C(=O)[C@@H](N)C(C)(C)C.
What is the InChIKey of (2S)-2-amino-N,N-diethyl-3,3-dimethylbutanamide?
The InChIKey is WAHPTCKZJXPLKY-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-6-12(7-2)9(13)8(11)10(3,4)5/h8H,6-7,11H2,1-5H3/t8-/m1/s1.
What are the key properties of (2S)-2-amino-N,N-diethyl-3,3-dimethylbutanamide?
(2S)-2-amino-N,N-diethyl-3,3-dimethylbutanamide has a molecular weight of 186.30 g/mol, XLogP of 1.23, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N,N-diethyl-3,3-dimethylbutanamide is sourced from PubChem (CID 25067345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).