2-amino-N-(4-hydroxy-1-methoxybutan-2-yl)-3,3-dimethylbutanamide

C11H24N2O3 — CID 106161090

IUPAC2-amino-N-(4-hydroxy-1-methoxybutan-2-yl)-3,3-dimethylbutanamide
SMILESCOCC(CCO)NC(=O)C(N)C(C)(C)C
InChIInChI=1S/C11H24N2O3/c1-11(2,3)9(12)10(15)13-8(5-6-14)7-16-4/h8-9,14H,5-7,12H2,1-4H3,(H,13,15)
InChIKeyVFCAELHGXFUSJC-UHFFFAOYSA-N
MW232.32 g/mol
LogP-0.13
Rot. Bonds6

About 2-amino-N-(4-hydroxy-1-methoxybutan-2-yl)-3,3-dimethylbutanamide

2-amino-N-(4-hydroxy-1-methoxybutan-2-yl)-3,3-dimethylbutanamide (PubChem CID 106161090) has the molecular formula C11H24N2O3 and a molecular weight of 232.32 g/mol. Its IUPAC name is 2-amino-N-(4-hydroxy-1-methoxybutan-2-yl)-3,3-dimethylbutanamide.

Molecular Properties

Compound Name2-amino-N-(4-hydroxy-1-methoxybutan-2-yl)-3,3-dimethylbutanamide
PubChem CID106161090
Molecular FormulaC11H24N2O3
Molecular Weight232.32 g/mol
Exact Mass232.18
IUPAC Name2-amino-N-(4-hydroxy-1-methoxybutan-2-yl)-3,3-dimethylbutanamide
SMILESCOCC(CCO)NC(=O)C(N)C(C)(C)C
InChIInChI=1S/C11H24N2O3/c1-11(2,3)9(12)10(15)13-8(5-6-14)7-16-4/h8-9,14H,5-7,12H2,1-4H3,(H,13,15)
InChIKeyVFCAELHGXFUSJC-UHFFFAOYSA-N
XLogP-0.13
TPSA84.58 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.32
LogP ≤ 5-0.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-2-amino-N-(1-hydroxy-3-methoxypropan-2-yl)-3,3-dimethylbutanamide
CID 106188319
(2S)-2-amino-N-(4-hydroxy-1-methoxybutan-2-yl)pentanamide
CID 106161059
2-amino-N-(1,3-dihydroxypropyl)-3,3-dimethylbutanamide;hydrochloride
CID 87213066
2-[[(2S)-2-amino-3,3-dimethylbutanoyl]amino]-4-methoxybutanoic acid
CID 62478300
tert-butyl N-[(2S)-4-hydroxy-1-methoxybutan-2-yl]carbamate
CID 53259998
4-[(4-hydroxy-1-methoxybutan-2-yl)amino]-2,2-dimethyl-4-oxobutanoic acid
CID 106155459
2-amino-N-(4-hydroxy-1-methoxybutan-2-yl)-2-methylbutanamide
CID 106160983
(2R)-2-amino-N-(1-hydroxy-4-methylpentan-3-yl)-3,3-dimethylbutanamide
CID 106349815
2-(tert-butylamino)-N-(4-hydroxy-1-methoxybutan-2-yl)acetamide
CID 103850862
4-[(4-hydroxy-1-methoxybutan-2-yl)amino]-4-oxobutanoic acid
CID 106155382
3-[(4-hydroxy-1-methoxybutan-2-yl)amino]-2,2-dimethylpropanoic acid
CID 106159803
3-amino-N-(4-hydroxy-1-methoxybutan-2-yl)-3-phenylpropanamide
CID 106161030

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(4-hydroxy-1-methoxybutan-2-yl)-3,3-dimethylbutanamide?
The IUPAC name of 2-amino-N-(4-hydroxy-1-methoxybutan-2-yl)-3,3-dimethylbutanamide (CID 106161090) is 2-amino-N-(4-hydroxy-1-methoxybutan-2-yl)-3,3-dimethylbutanamide.
What is the SMILES notation for 2-amino-N-(4-hydroxy-1-methoxybutan-2-yl)-3,3-dimethylbutanamide?
The canonical SMILES for 2-amino-N-(4-hydroxy-1-methoxybutan-2-yl)-3,3-dimethylbutanamide is COCC(CCO)NC(=O)C(N)C(C)(C)C.
What is the InChIKey of 2-amino-N-(4-hydroxy-1-methoxybutan-2-yl)-3,3-dimethylbutanamide?
The InChIKey is VFCAELHGXFUSJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O3/c1-11(2,3)9(12)10(15)13-8(5-6-14)7-16-4/h8-9,14H,5-7,12H2,1-4H3,(H,13,15).
What are the key properties of 2-amino-N-(4-hydroxy-1-methoxybutan-2-yl)-3,3-dimethylbutanamide?
2-amino-N-(4-hydroxy-1-methoxybutan-2-yl)-3,3-dimethylbutanamide has a molecular weight of 232.32 g/mol, XLogP of -0.13, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(4-hydroxy-1-methoxybutan-2-yl)-3,3-dimethylbutanamide is sourced from PubChem (CID 106161090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).