2-amino-N-(2-hydroxy-3-methoxypropyl)-N,3,3-trimethylbutanamide

C11H24N2O3 — CID 76911278

IUPAC2-amino-N-(2-hydroxy-3-methoxypropyl)-N,3,3-trimethylbutanamide
SMILESCOCC(O)CN(C)C(=O)C(N)C(C)(C)C
InChIInChI=1S/C11H24N2O3/c1-11(2,3)9(12)10(15)13(4)6-8(14)7-16-5/h8-9,14H,6-7,12H2,1-5H3
InChIKeyYMHGPYAKESOZJK-UHFFFAOYSA-N
MW232.32 g/mol
LogP-0.17
Rot. Bonds5

About 2-amino-N-(2-hydroxy-3-methoxypropyl)-N,3,3-trimethylbutanamide

2-amino-N-(2-hydroxy-3-methoxypropyl)-N,3,3-trimethylbutanamide (PubChem CID 76911278) has the molecular formula C11H24N2O3 and a molecular weight of 232.32 g/mol. Its IUPAC name is 2-amino-N-(2-hydroxy-3-methoxypropyl)-N,3,3-trimethylbutanamide.

Molecular Properties

Compound Name2-amino-N-(2-hydroxy-3-methoxypropyl)-N,3,3-trimethylbutanamide
PubChem CID76911278
Molecular FormulaC11H24N2O3
Molecular Weight232.32 g/mol
Exact Mass232.18
IUPAC Name2-amino-N-(2-hydroxy-3-methoxypropyl)-N,3,3-trimethylbutanamide
SMILESCOCC(O)CN(C)C(=O)C(N)C(C)(C)C
InChIInChI=1S/C11H24N2O3/c1-11(2,3)9(12)10(15)13(4)6-8(14)7-16-5/h8-9,14H,6-7,12H2,1-5H3
InChIKeyYMHGPYAKESOZJK-UHFFFAOYSA-N
XLogP-0.17
TPSA75.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.32
LogP ≤ 5-0.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-(2-hydroxy-3-methoxypropyl)-3-methoxy-N-methylpropanamide
CID 81089598
3-amino-4-[(2-hydroxy-3-methoxypropyl)-methylamino]-4-oxobutanoic acid
CID 64895957
3,3,3-trifluoro-N-(2-hydroxy-3-methoxypropyl)-N-methyl-2-(trifluoromethyl)propanamide
CID 103310159
3-amino-N-(2-hydroxy-3-methoxypropyl)-N,3-dimethylbutanamide
CID 64678232
N-(2-hydroxy-3-methoxypropyl)-2-methoxy-N,2-dimethylpropanamide
CID 103747204
2-amino-N-(2-hydroxy-3-methoxypropyl)-N,2-dimethylbutanamide
CID 79810651
(2S)-2-amino-N-ethyl-N,3,3-trimethylbutanamide
CID 61154665
(2S)-2-amino-N-[2-hydroxy-3-[2-(trifluoromethyl)phenoxy]propyl]-N,3,3-trimethylbutanamide;hydrochloride
CID 119741458
N-(2-hydroxy-3-methoxypropyl)-N-methylbut-2-ynamide
CID 106741532
(2S)-2-amino-N-(2-hydroxy-3-methoxypropyl)-N-methyl-4-phenylbutanamide
CID 104984250
2-[[(2-hydroxy-3-methoxypropyl)-methylcarbamoyl]amino]-2-methylbutanoic acid
CID 79800977
2-acetamido-N-(2-hydroxy-3-methoxypropyl)-N-methyl-3-sulfanylpropanamide
CID 107769331

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-hydroxy-3-methoxypropyl)-N,3,3-trimethylbutanamide?
The IUPAC name of 2-amino-N-(2-hydroxy-3-methoxypropyl)-N,3,3-trimethylbutanamide (CID 76911278) is 2-amino-N-(2-hydroxy-3-methoxypropyl)-N,3,3-trimethylbutanamide.
What is the SMILES notation for 2-amino-N-(2-hydroxy-3-methoxypropyl)-N,3,3-trimethylbutanamide?
The canonical SMILES for 2-amino-N-(2-hydroxy-3-methoxypropyl)-N,3,3-trimethylbutanamide is COCC(O)CN(C)C(=O)C(N)C(C)(C)C.
What is the InChIKey of 2-amino-N-(2-hydroxy-3-methoxypropyl)-N,3,3-trimethylbutanamide?
The InChIKey is YMHGPYAKESOZJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O3/c1-11(2,3)9(12)10(15)13(4)6-8(14)7-16-5/h8-9,14H,6-7,12H2,1-5H3.
What are the key properties of 2-amino-N-(2-hydroxy-3-methoxypropyl)-N,3,3-trimethylbutanamide?
2-amino-N-(2-hydroxy-3-methoxypropyl)-N,3,3-trimethylbutanamide has a molecular weight of 232.32 g/mol, XLogP of -0.17, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-hydroxy-3-methoxypropyl)-N,3,3-trimethylbutanamide is sourced from PubChem (CID 76911278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).