N,5-dimethyl-1,2-dihydropyridine-2-carboxamide

C8H12N2O — CID 122692046

IUPACN,5-dimethyl-1,2-dihydropyridine-2-carboxamide
SMILESCNC(=O)C1C=CC(C)=CN1
InChIInChI=1S/C8H12N2O/c1-6-3-4-7(10-5-6)8(11)9-2/h3-5,7,10H,1-2H3,(H,9,11)
InChIKeyUTTKCIYCWHLHNY-UHFFFAOYSA-N
MW152.20 g/mol
LogP0.16
Rot. Bonds1

About N,5-dimethyl-1,2-dihydropyridine-2-carboxamide

N,5-dimethyl-1,2-dihydropyridine-2-carboxamide (PubChem CID 122692046) has the molecular formula C8H12N2O and a molecular weight of 152.20 g/mol. Its IUPAC name is N,5-dimethyl-1,2-dihydropyridine-2-carboxamide.

Molecular Properties

Compound NameN,5-dimethyl-1,2-dihydropyridine-2-carboxamide
PubChem CID122692046
Molecular FormulaC8H12N2O
Molecular Weight152.20 g/mol
Exact Mass152.09
IUPAC NameN,5-dimethyl-1,2-dihydropyridine-2-carboxamide
SMILESCNC(=O)C1C=CC(C)=CN1
InChIInChI=1S/C8H12N2O/c1-6-3-4-7(10-5-6)8(11)9-2/h3-5,7,10H,1-2H3,(H,9,11)
InChIKeyUTTKCIYCWHLHNY-UHFFFAOYSA-N
XLogP0.16
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.20
LogP ≤ 50.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,5-dimethyl-1,2-dihydropyridine-2-carboxamide?
The IUPAC name of N,5-dimethyl-1,2-dihydropyridine-2-carboxamide (CID 122692046) is N,5-dimethyl-1,2-dihydropyridine-2-carboxamide.
What is the SMILES notation for N,5-dimethyl-1,2-dihydropyridine-2-carboxamide?
The canonical SMILES for N,5-dimethyl-1,2-dihydropyridine-2-carboxamide is CNC(=O)C1C=CC(C)=CN1.
What is the InChIKey of N,5-dimethyl-1,2-dihydropyridine-2-carboxamide?
The InChIKey is UTTKCIYCWHLHNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O/c1-6-3-4-7(10-5-6)8(11)9-2/h3-5,7,10H,1-2H3,(H,9,11).
What are the key properties of N,5-dimethyl-1,2-dihydropyridine-2-carboxamide?
N,5-dimethyl-1,2-dihydropyridine-2-carboxamide has a molecular weight of 152.20 g/mol, XLogP of 0.16, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,5-dimethyl-1,2-dihydropyridine-2-carboxamide is sourced from PubChem (CID 122692046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).