hydron;2H-pyran-4-carboxamide

C6H8NO2+ — CID 175124899

IUPAChydron;2H-pyran-4-carboxamide
SMILESNC(=O)C1=CCOC=C1.[H+]
InChIInChI=1S/C6H7NO2/c7-6(8)5-1-3-9-4-2-5/h1-3H,4H2,(H2,7,8)/p+1
InChIKeyHUPNQNOWXCVQSW-UHFFFAOYSA-O
MW126.13 g/mol
LogP0.05
Rot. Bonds1

About hydron;2H-pyran-4-carboxamide

hydron;2H-pyran-4-carboxamide (PubChem CID 175124899) has the molecular formula C6H8NO2+ and a molecular weight of 126.13 g/mol. Its IUPAC name is hydron;2H-pyran-4-carboxamide.

Molecular Properties

Compound Namehydron;2H-pyran-4-carboxamide
PubChem CID175124899
Molecular FormulaC6H8NO2+
Molecular Weight126.13 g/mol
Exact Mass126.05
IUPAC Namehydron;2H-pyran-4-carboxamide
SMILESNC(=O)C1=CCOC=C1.[H+]
InChIInChI=1S/C6H7NO2/c7-6(8)5-1-3-9-4-2-5/h1-3H,4H2,(H2,7,8)/p+1
InChIKeyHUPNQNOWXCVQSW-UHFFFAOYSA-O
XLogP0.05
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.13
LogP ≤ 50.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze hydron;2H-pyran-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of hydron;2H-pyran-4-carboxamide?
The IUPAC name of hydron;2H-pyran-4-carboxamide (CID 175124899) is hydron;2H-pyran-4-carboxamide.
What is the SMILES notation for hydron;2H-pyran-4-carboxamide?
The canonical SMILES for hydron;2H-pyran-4-carboxamide is NC(=O)C1=CCOC=C1.[H+].
What is the InChIKey of hydron;2H-pyran-4-carboxamide?
The InChIKey is HUPNQNOWXCVQSW-UHFFFAOYSA-O. The full InChI is InChI=1S/C6H7NO2/c7-6(8)5-1-3-9-4-2-5/h1-3H,4H2,(H2,7,8)/p+1.
What are the key properties of hydron;2H-pyran-4-carboxamide?
hydron;2H-pyran-4-carboxamide has a molecular weight of 126.13 g/mol, XLogP of 0.05, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for hydron;2H-pyran-4-carboxamide is sourced from PubChem (CID 175124899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).