2,5-dihydropyridine-3-carboxamide

C6H8N2O — CID 57050462

IUPAC2,5-dihydropyridine-3-carboxamide
SMILESNC(=O)C1=CCC=NC1
InChIInChI=1S/C6H8N2O/c7-6(9)5-2-1-3-8-4-5/h2-3H,1,4H2,(H2,7,9)
InChIKeyPHSIXSAAZKIJDL-UHFFFAOYSA-N
MW124.14 g/mol
LogP-0.13
Rot. Bonds1

About 2,5-dihydropyridine-3-carboxamide

2,5-dihydropyridine-3-carboxamide (PubChem CID 57050462) has the molecular formula C6H8N2O and a molecular weight of 124.14 g/mol. Its IUPAC name is 2,5-dihydropyridine-3-carboxamide.

Molecular Properties

Compound Name2,5-dihydropyridine-3-carboxamide
PubChem CID57050462
Molecular FormulaC6H8N2O
Molecular Weight124.14 g/mol
Exact Mass124.06
IUPAC Name2,5-dihydropyridine-3-carboxamide
SMILESNC(=O)C1=CCC=NC1
InChIInChI=1S/C6H8N2O/c7-6(9)5-2-1-3-8-4-5/h2-3H,1,4H2,(H2,7,9)
InChIKeyPHSIXSAAZKIJDL-UHFFFAOYSA-N
XLogP-0.13
TPSA55.45 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.14
LogP ≤ 5-0.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(trifluoromethyl)-2,5-dihydropyridine-3-carboxamide
CID 91409952
5,5-diamino-2H-pyridine-3-carboxamide
CID 17941915
6-Amino-2,5-dihydropyridine-3-carboxamide
CID 53672120
2,5-Dihydropyridine-4-carboxamide
CID 57070802
3H-pyridin-1-ium-4-carboxamide
CID 57095584
3H-pyridin-1-ium-5-carboxamide
CID 57163846
5-methyl-3H-pyridin-6-one
CID 57604477
5,5-Dimethyl-6-oxopyridine-3-carboxamide
CID 66728116
2,3-Dihydropyridine-5-carboxamide
CID 69027120
2,3-Dihydropyridine-3,5-dicarboxamide
CID 90027121
N-oxo-2,5-dihydropyridine-3-carboxamide
CID 91574679
2,3-Dihydropyridine-4-carboxamide
CID 91606672

Frequently Asked Questions

What is the IUPAC name of 2,5-dihydropyridine-3-carboxamide?
The IUPAC name of 2,5-dihydropyridine-3-carboxamide (CID 57050462) is 2,5-dihydropyridine-3-carboxamide.
What is the SMILES notation for 2,5-dihydropyridine-3-carboxamide?
The canonical SMILES for 2,5-dihydropyridine-3-carboxamide is NC(=O)C1=CCC=NC1.
What is the InChIKey of 2,5-dihydropyridine-3-carboxamide?
The InChIKey is PHSIXSAAZKIJDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2O/c7-6(9)5-2-1-3-8-4-5/h2-3H,1,4H2,(H2,7,9).
What are the key properties of 2,5-dihydropyridine-3-carboxamide?
2,5-dihydropyridine-3-carboxamide has a molecular weight of 124.14 g/mol, XLogP of -0.13, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dihydropyridine-3-carboxamide is sourced from PubChem (CID 57050462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).