2-[acetyl(methyl)amino]-N-hydroxypropanamide

C6H12N2O3 — CID 20680996

IUPAC2-[acetyl(methyl)amino]-N-hydroxypropanamide
SMILESCC(=O)N(C)C(C)C(=O)NO
InChIInChI=1S/C6H12N2O3/c1-4(6(10)7-11)8(3)5(2)9/h4,11H,1-3H3,(H,7,10)
InChIKeyUIDAJOIUXVQSQP-UHFFFAOYSA-N
MW160.17 g/mol
LogP-0.64
Rot. Bonds2

About 2-[acetyl(methyl)amino]-N-hydroxypropanamide

2-[acetyl(methyl)amino]-N-hydroxypropanamide (PubChem CID 20680996) has the molecular formula C6H12N2O3 and a molecular weight of 160.17 g/mol. Its IUPAC name is 2-[acetyl(methyl)amino]-N-hydroxypropanamide.

Molecular Properties

Compound Name2-[acetyl(methyl)amino]-N-hydroxypropanamide
PubChem CID20680996
Molecular FormulaC6H12N2O3
Molecular Weight160.17 g/mol
Exact Mass160.08
IUPAC Name2-[acetyl(methyl)amino]-N-hydroxypropanamide
SMILESCC(=O)N(C)C(C)C(=O)NO
InChIInChI=1S/C6H12N2O3/c1-4(6(10)7-11)8(3)5(2)9/h4,11H,1-3H3,(H,7,10)
InChIKeyUIDAJOIUXVQSQP-UHFFFAOYSA-N
XLogP-0.64
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.17
LogP ≤ 5-0.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(2R)-2-amino-N-[(2R)-1-(hydroxyamino)-1-oxopropan-2-yl]propanamide;hydrobromide
CID 90678147
(2R)-2-amino-N-[1-(hydroxyamino)-1-oxopropan-2-yl]propanamide;hydrobromide
CID 90678150
2-(diethylamino)-N-hydroxyacetamide
CID 13277022
Propanohydroxamic acid, 2-dimethylamino-
CID 45087498
2-amino-N-hydroxy-N-(propan-2-yl)acetamide hydrochloride
CID 132398569
Propanohydroxamic acid, 2-trimethylammonio-, iodide
CID 171384066
2-acetamido-3-fluoro-N-hydroxypropanamide
CID 141950441
(2S)-2-[acetyl(methyl)amino]propanamide
CID 55282132
2-Amino-N-hydroxy-N-(propan-2-YL)acetamide
CID 10240839
(2R)-2-amino-N-[(2R)-1-(hydroxyamino)-1-oxopropan-2-yl]propanamide
CID 90678148
(2R)-2-amino-N-[1-(hydroxyamino)-1-oxopropan-2-yl]propanamide
CID 90678151
(2S)-2-amino-N-[2-(hydroxyamino)-2-oxoethyl]propanamide
CID 10329576

Frequently Asked Questions

What is the IUPAC name of 2-[acetyl(methyl)amino]-N-hydroxypropanamide?
The IUPAC name of 2-[acetyl(methyl)amino]-N-hydroxypropanamide (CID 20680996) is 2-[acetyl(methyl)amino]-N-hydroxypropanamide.
What is the SMILES notation for 2-[acetyl(methyl)amino]-N-hydroxypropanamide?
The canonical SMILES for 2-[acetyl(methyl)amino]-N-hydroxypropanamide is CC(=O)N(C)C(C)C(=O)NO.
What is the InChIKey of 2-[acetyl(methyl)amino]-N-hydroxypropanamide?
The InChIKey is UIDAJOIUXVQSQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O3/c1-4(6(10)7-11)8(3)5(2)9/h4,11H,1-3H3,(H,7,10).
What are the key properties of 2-[acetyl(methyl)amino]-N-hydroxypropanamide?
2-[acetyl(methyl)amino]-N-hydroxypropanamide has a molecular weight of 160.17 g/mol, XLogP of -0.64, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[acetyl(methyl)amino]-N-hydroxypropanamide is sourced from PubChem (CID 20680996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).