N,6-dimethyl-2-oxo-N-(pyridin-3-ylmethyl)-1H-pyridine-3-carboxamide

C14H15N3O2 — CID 78893836

IUPACN,6-dimethyl-2-oxo-N-(pyridin-3-ylmethyl)-1H-pyridine-3-carboxamide
SMILESCc1ccc(C(=O)N(C)Cc2cccnc2)c(=O)[nH]1
InChIInChI=1S/C14H15N3O2/c1-10-5-6-12(13(18)16-10)14(19)17(2)9-11-4-3-7-15-8-11/h3-8H,9H2,1-2H3,(H,16,18)
InChIKeyBWSWUWWVYBWFBO-UHFFFAOYSA-N
MW257.29 g/mol
LogP1.35
Rot. Bonds3

About N,6-dimethyl-2-oxo-N-(pyridin-3-ylmethyl)-1H-pyridine-3-carboxamide

N,6-dimethyl-2-oxo-N-(pyridin-3-ylmethyl)-1H-pyridine-3-carboxamide (PubChem CID 78893836) has the molecular formula C14H15N3O2 and a molecular weight of 257.29 g/mol. Its IUPAC name is N,6-dimethyl-2-oxo-N-(pyridin-3-ylmethyl)-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN,6-dimethyl-2-oxo-N-(pyridin-3-ylmethyl)-1H-pyridine-3-carboxamide
PubChem CID78893836
Molecular FormulaC14H15N3O2
Molecular Weight257.29 g/mol
Exact Mass257.12
IUPAC NameN,6-dimethyl-2-oxo-N-(pyridin-3-ylmethyl)-1H-pyridine-3-carboxamide
SMILESCc1ccc(C(=O)N(C)Cc2cccnc2)c(=O)[nH]1
InChIInChI=1S/C14H15N3O2/c1-10-5-6-12(13(18)16-10)14(19)17(2)9-11-4-3-7-15-8-11/h3-8H,9H2,1-2H3,(H,16,18)
InChIKeyBWSWUWWVYBWFBO-UHFFFAOYSA-N
XLogP1.35
TPSA66.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-iodo-N-methyl-N-(pyridin-3-ylmethyl)benzamide
CID 47097163
3-fluoro-N-methyl-N-(pyridin-3-ylmethyl)pyridine-4-carboxamide
CID 113240917
2-bromo-N,3-dimethyl-N-(pyridin-3-ylmethyl)benzamide
CID 103852811
2-hydrazinyl-N-methyl-N-(pyridin-3-ylmethyl)benzamide
CID 62243618
3,5-dihydroxy-N-methyl-N-(pyridin-3-ylmethyl)benzamide
CID 103891587
3,5-dimethoxy-N-methyl-N-(pyridin-3-ylmethyl)benzamide
CID 6734292
2-amino-4-fluoro-N-methyl-N-(pyridin-3-ylmethyl)benzamide
CID 63109669
5-amino-N,2-dimethyl-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide
CID 54916915
4-bromo-2-fluoro-N-methyl-N-(pyridin-3-ylmethyl)benzamide
CID 43401146
2-methyl-6-[methyl(pyridin-3-ylmethyl)carbamoyl]pyridine-3-carboxylic acid
CID 43563869
4-tert-butyl-N-methyl-N-(pyridin-3-ylmethyl)benzamide
CID 86932717
N-methyl-N-(pyridin-3-ylmethyl)quinoline-8-carboxamide
CID 39948382

Frequently Asked Questions

What is the IUPAC name of N,6-dimethyl-2-oxo-N-(pyridin-3-ylmethyl)-1H-pyridine-3-carboxamide?
The IUPAC name of N,6-dimethyl-2-oxo-N-(pyridin-3-ylmethyl)-1H-pyridine-3-carboxamide (CID 78893836) is N,6-dimethyl-2-oxo-N-(pyridin-3-ylmethyl)-1H-pyridine-3-carboxamide.
What is the SMILES notation for N,6-dimethyl-2-oxo-N-(pyridin-3-ylmethyl)-1H-pyridine-3-carboxamide?
The canonical SMILES for N,6-dimethyl-2-oxo-N-(pyridin-3-ylmethyl)-1H-pyridine-3-carboxamide is Cc1ccc(C(=O)N(C)Cc2cccnc2)c(=O)[nH]1.
What is the InChIKey of N,6-dimethyl-2-oxo-N-(pyridin-3-ylmethyl)-1H-pyridine-3-carboxamide?
The InChIKey is BWSWUWWVYBWFBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2/c1-10-5-6-12(13(18)16-10)14(19)17(2)9-11-4-3-7-15-8-11/h3-8H,9H2,1-2H3,(H,16,18).
What are the key properties of N,6-dimethyl-2-oxo-N-(pyridin-3-ylmethyl)-1H-pyridine-3-carboxamide?
N,6-dimethyl-2-oxo-N-(pyridin-3-ylmethyl)-1H-pyridine-3-carboxamide has a molecular weight of 257.29 g/mol, XLogP of 1.35, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,6-dimethyl-2-oxo-N-(pyridin-3-ylmethyl)-1H-pyridine-3-carboxamide is sourced from PubChem (CID 78893836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).