(2S)-2-amino-N-(1-hydroxy-2-methylpropan-2-yl)-3,3-dimethylbutanamide

C10H22N2O2 — CID 61154008

IUPAC(2S)-2-amino-N-(1-hydroxy-2-methylpropan-2-yl)-3,3-dimethylbutanamide
SMILESCC(C)(CO)NC(=O)[C@@H](N)C(C)(C)C
InChIInChI=1S/C10H22N2O2/c1-9(2,3)7(11)8(14)12-10(4,5)6-13/h7,13H,6,11H2,1-5H3,(H,12,14)/t7-/m1/s1
InChIKeyZITGFYFCIIWCAY-SSDOTTSWSA-N
MW202.30 g/mol
LogP0.25
Rot. Bonds3

About (2S)-2-amino-N-(1-hydroxy-2-methylpropan-2-yl)-3,3-dimethylbutanamide

(2S)-2-amino-N-(1-hydroxy-2-methylpropan-2-yl)-3,3-dimethylbutanamide (PubChem CID 61154008) has the molecular formula C10H22N2O2 and a molecular weight of 202.30 g/mol. Its IUPAC name is (2S)-2-amino-N-(1-hydroxy-2-methylpropan-2-yl)-3,3-dimethylbutanamide.

Molecular Properties

Compound Name(2S)-2-amino-N-(1-hydroxy-2-methylpropan-2-yl)-3,3-dimethylbutanamide
PubChem CID61154008
Molecular FormulaC10H22N2O2
Molecular Weight202.30 g/mol
Exact Mass202.17
IUPAC Name(2S)-2-amino-N-(1-hydroxy-2-methylpropan-2-yl)-3,3-dimethylbutanamide
SMILESCC(C)(CO)NC(=O)[C@@H](N)C(C)(C)C
InChIInChI=1S/C10H22N2O2/c1-9(2,3)7(11)8(14)12-10(4,5)6-13/h7,13H,6,11H2,1-5H3,(H,12,14)/t7-/m1/s1
InChIKeyZITGFYFCIIWCAY-SSDOTTSWSA-N
XLogP0.25
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 50.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-amino-N-(4-hydroxy-2-methylbutan-2-yl)-3,3-dimethylbutanamide
CID 104873423
2-amino-3,3-dimethyl-N-(2,4,4-trimethylpentan-2-yl)butanamide
CID 76887560
(2S)-2-amino-N-(1-methoxy-2-methylpropan-2-yl)-3,3-dimethylbutanamide
CID 104862136
(2R)-2-amino-N-[3-(hydroxymethyl)pentan-3-yl]-3,3-dimethylbutanamide
CID 103929829
(2S)-2-amino-N-(1-hydroxy-2-methylpropan-2-yl)-3-methylpentanamide
CID 61173516
(2S)-2-amino-N-(3-hydroxy-2,2-dimethylpropyl)-3,3-dimethylbutanamide
CID 115360318
N-(1-hydroxy-2-methylpropan-2-yl)-2,2-dimethoxyacetamide
CID 10375287
3-[(1-hydroxy-2-methylpropan-2-yl)amino]-2-methyl-3-oxopropanoic acid
CID 114897796
(2R)-2-amino-N-[4-(hydroxymethyl)cyclohexyl]-3,3-dimethylbutanamide
CID 112753369
(2R)-2-amino-N-(2,3-dihydroxy-2-methylpropyl)-3,3-dimethylbutanamide
CID 103930127
2-[(2-amino-3,3-dimethylbutanoyl)amino]-2-ethylbutanoic acid
CID 112555766
(2S)-2-amino-N-hydroxy-3,3-dimethylbutanamide
CID 63992597

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-(1-hydroxy-2-methylpropan-2-yl)-3,3-dimethylbutanamide?
The IUPAC name of (2S)-2-amino-N-(1-hydroxy-2-methylpropan-2-yl)-3,3-dimethylbutanamide (CID 61154008) is (2S)-2-amino-N-(1-hydroxy-2-methylpropan-2-yl)-3,3-dimethylbutanamide.
What is the SMILES notation for (2S)-2-amino-N-(1-hydroxy-2-methylpropan-2-yl)-3,3-dimethylbutanamide?
The canonical SMILES for (2S)-2-amino-N-(1-hydroxy-2-methylpropan-2-yl)-3,3-dimethylbutanamide is CC(C)(CO)NC(=O)[C@@H](N)C(C)(C)C.
What is the InChIKey of (2S)-2-amino-N-(1-hydroxy-2-methylpropan-2-yl)-3,3-dimethylbutanamide?
The InChIKey is ZITGFYFCIIWCAY-SSDOTTSWSA-N. The full InChI is InChI=1S/C10H22N2O2/c1-9(2,3)7(11)8(14)12-10(4,5)6-13/h7,13H,6,11H2,1-5H3,(H,12,14)/t7-/m1/s1.
What are the key properties of (2S)-2-amino-N-(1-hydroxy-2-methylpropan-2-yl)-3,3-dimethylbutanamide?
(2S)-2-amino-N-(1-hydroxy-2-methylpropan-2-yl)-3,3-dimethylbutanamide has a molecular weight of 202.30 g/mol, XLogP of 0.25, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-(1-hydroxy-2-methylpropan-2-yl)-3,3-dimethylbutanamide is sourced from PubChem (CID 61154008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).