N,N-dihydroxy-2-(6-oxo-1-propyl-2,3-dihydropyridin-5-yl)acetamide

C10H16N2O4 — CID 87407774

IUPACN,N-dihydroxy-2-(6-oxo-1-propyl-2,3-dihydropyridin-5-yl)acetamide
SMILESCCCN1CCC=C(CC(=O)N(O)O)C1=O
InChIInChI=1S/C10H16N2O4/c1-2-5-11-6-3-4-8(10(11)14)7-9(13)12(15)16/h4,15-16H,2-3,5-7H2,1H3
InChIKeyXTSJBIRUCDGUGB-UHFFFAOYSA-N
MW228.25 g/mol
LogP0.55
Rot. Bonds4

About N,N-dihydroxy-2-(6-oxo-1-propyl-2,3-dihydropyridin-5-yl)acetamide

N,N-dihydroxy-2-(6-oxo-1-propyl-2,3-dihydropyridin-5-yl)acetamide (PubChem CID 87407774) has the molecular formula C10H16N2O4 and a molecular weight of 228.25 g/mol. Its IUPAC name is N,N-dihydroxy-2-(6-oxo-1-propyl-2,3-dihydropyridin-5-yl)acetamide.

Molecular Properties

Compound NameN,N-dihydroxy-2-(6-oxo-1-propyl-2,3-dihydropyridin-5-yl)acetamide
PubChem CID87407774
Molecular FormulaC10H16N2O4
Molecular Weight228.25 g/mol
Exact Mass228.11
IUPAC NameN,N-dihydroxy-2-(6-oxo-1-propyl-2,3-dihydropyridin-5-yl)acetamide
SMILESCCCN1CCC=C(CC(=O)N(O)O)C1=O
InChIInChI=1S/C10H16N2O4/c1-2-5-11-6-3-4-8(10(11)14)7-9(13)12(15)16/h4,15-16H,2-3,5-7H2,1H3
InChIKeyXTSJBIRUCDGUGB-UHFFFAOYSA-N
XLogP0.55
TPSA81.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.25
LogP ≤ 50.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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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Frequently Asked Questions

What is the IUPAC name of N,N-dihydroxy-2-(6-oxo-1-propyl-2,3-dihydropyridin-5-yl)acetamide?
The IUPAC name of N,N-dihydroxy-2-(6-oxo-1-propyl-2,3-dihydropyridin-5-yl)acetamide (CID 87407774) is N,N-dihydroxy-2-(6-oxo-1-propyl-2,3-dihydropyridin-5-yl)acetamide.
What is the SMILES notation for N,N-dihydroxy-2-(6-oxo-1-propyl-2,3-dihydropyridin-5-yl)acetamide?
The canonical SMILES for N,N-dihydroxy-2-(6-oxo-1-propyl-2,3-dihydropyridin-5-yl)acetamide is CCCN1CCC=C(CC(=O)N(O)O)C1=O.
What is the InChIKey of N,N-dihydroxy-2-(6-oxo-1-propyl-2,3-dihydropyridin-5-yl)acetamide?
The InChIKey is XTSJBIRUCDGUGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O4/c1-2-5-11-6-3-4-8(10(11)14)7-9(13)12(15)16/h4,15-16H,2-3,5-7H2,1H3.
What are the key properties of N,N-dihydroxy-2-(6-oxo-1-propyl-2,3-dihydropyridin-5-yl)acetamide?
N,N-dihydroxy-2-(6-oxo-1-propyl-2,3-dihydropyridin-5-yl)acetamide has a molecular weight of 228.25 g/mol, XLogP of 0.55, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dihydroxy-2-(6-oxo-1-propyl-2,3-dihydropyridin-5-yl)acetamide is sourced from PubChem (CID 87407774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).