2-anilino-2H-pyran-6-carboxamide

C12H12N2O2 — CID 172587897

IUPAC2-anilino-2H-pyran-6-carboxamide
SMILESNC(=O)C1=CC=CC(Nc2ccccc2)O1
InChIInChI=1S/C12H12N2O2/c13-12(15)10-7-4-8-11(16-10)14-9-5-2-1-3-6-9/h1-8,11,14H,(H2,13,15)
InChIKeyXJYMMCCDLJNDRP-UHFFFAOYSA-N
MW216.24 g/mol
LogP1.38
Rot. Bonds3

About 2-anilino-2H-pyran-6-carboxamide

2-anilino-2H-pyran-6-carboxamide (PubChem CID 172587897) has the molecular formula C12H12N2O2 and a molecular weight of 216.24 g/mol. Its IUPAC name is 2-anilino-2H-pyran-6-carboxamide.

Molecular Properties

Compound Name2-anilino-2H-pyran-6-carboxamide
PubChem CID172587897
Molecular FormulaC12H12N2O2
Molecular Weight216.24 g/mol
Exact Mass216.09
IUPAC Name2-anilino-2H-pyran-6-carboxamide
SMILESNC(=O)C1=CC=CC(Nc2ccccc2)O1
InChIInChI=1S/C12H12N2O2/c13-12(15)10-7-4-8-11(16-10)14-9-5-2-1-3-6-9/h1-8,11,14H,(H2,13,15)
InChIKeyXJYMMCCDLJNDRP-UHFFFAOYSA-N
XLogP1.38
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.24
LogP ≤ 51.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-anilino-2H-pyran-6-carboxamide?
The IUPAC name of 2-anilino-2H-pyran-6-carboxamide (CID 172587897) is 2-anilino-2H-pyran-6-carboxamide.
What is the SMILES notation for 2-anilino-2H-pyran-6-carboxamide?
The canonical SMILES for 2-anilino-2H-pyran-6-carboxamide is NC(=O)C1=CC=CC(Nc2ccccc2)O1.
What is the InChIKey of 2-anilino-2H-pyran-6-carboxamide?
The InChIKey is XJYMMCCDLJNDRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O2/c13-12(15)10-7-4-8-11(16-10)14-9-5-2-1-3-6-9/h1-8,11,14H,(H2,13,15).
What are the key properties of 2-anilino-2H-pyran-6-carboxamide?
2-anilino-2H-pyran-6-carboxamide has a molecular weight of 216.24 g/mol, XLogP of 1.38, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-anilino-2H-pyran-6-carboxamide is sourced from PubChem (CID 172587897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).