N-hydroxy-N-methyl-5-propan-2-ylpyridine-3-carboxamide

C10H14N2O2 — CID 175633348

IUPACN-hydroxy-N-methyl-5-propan-2-ylpyridine-3-carboxamide
SMILESCC(C)c1cncc(C(=O)N(C)O)c1
InChIInChI=1S/C10H14N2O2/c1-7(2)8-4-9(6-11-5-8)10(13)12(3)14/h4-7,14H,1-3H3
InChIKeyQMVFJHQBUGGPNK-UHFFFAOYSA-N
MW194.23 g/mol
LogP1.67
Rot. Bonds2

About N-hydroxy-N-methyl-5-propan-2-ylpyridine-3-carboxamide

N-hydroxy-N-methyl-5-propan-2-ylpyridine-3-carboxamide (PubChem CID 175633348) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is N-hydroxy-N-methyl-5-propan-2-ylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-hydroxy-N-methyl-5-propan-2-ylpyridine-3-carboxamide
PubChem CID175633348
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC NameN-hydroxy-N-methyl-5-propan-2-ylpyridine-3-carboxamide
SMILESCC(C)c1cncc(C(=O)N(C)O)c1
InChIInChI=1S/C10H14N2O2/c1-7(2)8-4-9(6-11-5-8)10(13)12(3)14/h4-7,14H,1-3H3
InChIKeyQMVFJHQBUGGPNK-UHFFFAOYSA-N
XLogP1.67
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 51.67
H-Bond Donors ≤ 51
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-N-methyl-5-propan-2-ylpyridine-3-carboxamide?
The IUPAC name of N-hydroxy-N-methyl-5-propan-2-ylpyridine-3-carboxamide (CID 175633348) is N-hydroxy-N-methyl-5-propan-2-ylpyridine-3-carboxamide.
What is the SMILES notation for N-hydroxy-N-methyl-5-propan-2-ylpyridine-3-carboxamide?
The canonical SMILES for N-hydroxy-N-methyl-5-propan-2-ylpyridine-3-carboxamide is CC(C)c1cncc(C(=O)N(C)O)c1.
What is the InChIKey of N-hydroxy-N-methyl-5-propan-2-ylpyridine-3-carboxamide?
The InChIKey is QMVFJHQBUGGPNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-7(2)8-4-9(6-11-5-8)10(13)12(3)14/h4-7,14H,1-3H3.
What are the key properties of N-hydroxy-N-methyl-5-propan-2-ylpyridine-3-carboxamide?
N-hydroxy-N-methyl-5-propan-2-ylpyridine-3-carboxamide has a molecular weight of 194.23 g/mol, XLogP of 1.67, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-N-methyl-5-propan-2-ylpyridine-3-carboxamide is sourced from PubChem (CID 175633348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).