N-hydroxy-1-methyl-3,6-dihydro-2H-pyridine-4-carboxamide

C7H12N2O2 — CID 130205235

IUPACN-hydroxy-1-methyl-3,6-dihydro-2H-pyridine-4-carboxamide
SMILESCN1CC=C(C(=O)NO)CC1
InChIInChI=1S/C7H12N2O2/c1-9-4-2-6(3-5-9)7(10)8-11/h2,11H,3-5H2,1H3,(H,8,10)
InChIKeyJMYNAJGJUSKVPA-UHFFFAOYSA-N
MW156.19 g/mol
LogP-0.25
Rot. Bonds1

About N-hydroxy-1-methyl-3,6-dihydro-2H-pyridine-4-carboxamide

N-hydroxy-1-methyl-3,6-dihydro-2H-pyridine-4-carboxamide (PubChem CID 130205235) has the molecular formula C7H12N2O2 and a molecular weight of 156.19 g/mol. Its IUPAC name is N-hydroxy-1-methyl-3,6-dihydro-2H-pyridine-4-carboxamide.

Molecular Properties

Compound NameN-hydroxy-1-methyl-3,6-dihydro-2H-pyridine-4-carboxamide
PubChem CID130205235
Molecular FormulaC7H12N2O2
Molecular Weight156.19 g/mol
Exact Mass156.09
IUPAC NameN-hydroxy-1-methyl-3,6-dihydro-2H-pyridine-4-carboxamide
SMILESCN1CC=C(C(=O)NO)CC1
InChIInChI=1S/C7H12N2O2/c1-9-4-2-6(3-5-9)7(10)8-11/h2,11H,3-5H2,1H3,(H,8,10)
InChIKeyJMYNAJGJUSKVPA-UHFFFAOYSA-N
XLogP-0.25
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.19
LogP ≤ 5-0.25
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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Frequently Asked Questions

What is the IUPAC name of N-hydroxy-1-methyl-3,6-dihydro-2H-pyridine-4-carboxamide?
The IUPAC name of N-hydroxy-1-methyl-3,6-dihydro-2H-pyridine-4-carboxamide (CID 130205235) is N-hydroxy-1-methyl-3,6-dihydro-2H-pyridine-4-carboxamide.
What is the SMILES notation for N-hydroxy-1-methyl-3,6-dihydro-2H-pyridine-4-carboxamide?
The canonical SMILES for N-hydroxy-1-methyl-3,6-dihydro-2H-pyridine-4-carboxamide is CN1CC=C(C(=O)NO)CC1.
What is the InChIKey of N-hydroxy-1-methyl-3,6-dihydro-2H-pyridine-4-carboxamide?
The InChIKey is JMYNAJGJUSKVPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O2/c1-9-4-2-6(3-5-9)7(10)8-11/h2,11H,3-5H2,1H3,(H,8,10).
What are the key properties of N-hydroxy-1-methyl-3,6-dihydro-2H-pyridine-4-carboxamide?
N-hydroxy-1-methyl-3,6-dihydro-2H-pyridine-4-carboxamide has a molecular weight of 156.19 g/mol, XLogP of -0.25, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-1-methyl-3,6-dihydro-2H-pyridine-4-carboxamide is sourced from PubChem (CID 130205235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).