N-hydroxy-1-methylpiperidine-4-carboxamide

C7H14N2O2 — CID 54232127

IUPACN-hydroxy-1-methylpiperidine-4-carboxamide
SMILESCN1CCC(C(=O)NO)CC1
InChIInChI=1S/C7H14N2O2/c1-9-4-2-6(3-5-9)7(10)8-11/h6,11H,2-5H2,1H3,(H,8,10)
InChIKeyQKAGQHOCLPJJHA-UHFFFAOYSA-N
MW158.20 g/mol
LogP-0.17
Rot. Bonds1

About N-hydroxy-1-methylpiperidine-4-carboxamide

N-hydroxy-1-methylpiperidine-4-carboxamide (PubChem CID 54232127) has the molecular formula C7H14N2O2 and a molecular weight of 158.20 g/mol. Its IUPAC name is N-hydroxy-1-methylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-hydroxy-1-methylpiperidine-4-carboxamide
PubChem CID54232127
Molecular FormulaC7H14N2O2
Molecular Weight158.20 g/mol
Exact Mass158.11
IUPAC NameN-hydroxy-1-methylpiperidine-4-carboxamide
SMILESCN1CCC(C(=O)NO)CC1
InChIInChI=1S/C7H14N2O2/c1-9-4-2-6(3-5-9)7(10)8-11/h6,11H,2-5H2,1H3,(H,8,10)
InChIKeyQKAGQHOCLPJJHA-UHFFFAOYSA-N
XLogP-0.17
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.20
LogP ≤ 5-0.17
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-methylpiperidine-4-carboxamide?
The IUPAC name of N-hydroxy-1-methylpiperidine-4-carboxamide (CID 54232127) is N-hydroxy-1-methylpiperidine-4-carboxamide.
What is the SMILES notation for N-hydroxy-1-methylpiperidine-4-carboxamide?
The canonical SMILES for N-hydroxy-1-methylpiperidine-4-carboxamide is CN1CCC(C(=O)NO)CC1.
What is the InChIKey of N-hydroxy-1-methylpiperidine-4-carboxamide?
The InChIKey is QKAGQHOCLPJJHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O2/c1-9-4-2-6(3-5-9)7(10)8-11/h6,11H,2-5H2,1H3,(H,8,10).
What are the key properties of N-hydroxy-1-methylpiperidine-4-carboxamide?
N-hydroxy-1-methylpiperidine-4-carboxamide has a molecular weight of 158.20 g/mol, XLogP of -0.17, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-1-methylpiperidine-4-carboxamide is sourced from PubChem (CID 54232127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).