N-(1-hydroxy-2-pyridinylidene)propanamide

C8H10N2O2 — CID 141394115

IUPACN-(1-hydroxy-2-pyridinylidene)propanamide
SMILESCCC(=O)/N=c1\ccccn1O
InChIInChI=1S/C8H10N2O2/c1-2-8(11)9-7-5-3-4-6-10(7)12/h3-6,12H,2H2,1H3/b9-7+
InChIKeyYVDZGNBAKAOMRP-VQHVLOKHSA-N
MW166.18 g/mol
LogP0.56
Rot. Bonds1

About N-(1-hydroxy-2-pyridinylidene)propanamide

N-(1-hydroxy-2-pyridinylidene)propanamide (PubChem CID 141394115) has the molecular formula C8H10N2O2 and a molecular weight of 166.18 g/mol. Its IUPAC name is N-(1-hydroxy-2-pyridinylidene)propanamide.

Molecular Properties

Compound NameN-(1-hydroxy-2-pyridinylidene)propanamide
PubChem CID141394115
Molecular FormulaC8H10N2O2
Molecular Weight166.18 g/mol
Exact Mass166.07
IUPAC NameN-(1-hydroxy-2-pyridinylidene)propanamide
SMILESCCC(=O)/N=c1\ccccn1O
InChIInChI=1S/C8H10N2O2/c1-2-8(11)9-7-5-3-4-6-10(7)12/h3-6,12H,2H2,1H3/b9-7+
InChIKeyYVDZGNBAKAOMRP-VQHVLOKHSA-N
XLogP0.56
TPSA54.59 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.18
LogP ≤ 50.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-hydroxyl_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxy-2-pyridinylidene)propanamide?
The IUPAC name of N-(1-hydroxy-2-pyridinylidene)propanamide (CID 141394115) is N-(1-hydroxy-2-pyridinylidene)propanamide.
What is the SMILES notation for N-(1-hydroxy-2-pyridinylidene)propanamide?
The canonical SMILES for N-(1-hydroxy-2-pyridinylidene)propanamide is CCC(=O)/N=c1\ccccn1O.
What is the InChIKey of N-(1-hydroxy-2-pyridinylidene)propanamide?
The InChIKey is YVDZGNBAKAOMRP-VQHVLOKHSA-N. The full InChI is InChI=1S/C8H10N2O2/c1-2-8(11)9-7-5-3-4-6-10(7)12/h3-6,12H,2H2,1H3/b9-7+.
What are the key properties of N-(1-hydroxy-2-pyridinylidene)propanamide?
N-(1-hydroxy-2-pyridinylidene)propanamide has a molecular weight of 166.18 g/mol, XLogP of 0.56, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxy-2-pyridinylidene)propanamide is sourced from PubChem (CID 141394115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).