N-methyl-4-oxo-N-(2-pyridin-4-ylethyl)-1H-pyridine-3-carboxamide

C14H15N3O2 — CID 103337389

IUPACN-methyl-4-oxo-N-(2-pyridin-4-ylethyl)-1H-pyridine-3-carboxamide
SMILESCN(CCc1ccncc1)C(=O)c1c[nH]ccc1=O
InChIInChI=1S/C14H15N3O2/c1-17(9-5-11-2-6-15-7-3-11)14(19)12-10-16-8-4-13(12)18/h2-4,6-8,10H,5,9H2,1H3,(H,16,18)
InChIKeyXMADVNCFSHFXHN-UHFFFAOYSA-N
MW257.29 g/mol
LogP1.08
Rot. Bonds4

About N-methyl-4-oxo-N-(2-pyridin-4-ylethyl)-1H-pyridine-3-carboxamide

N-methyl-4-oxo-N-(2-pyridin-4-ylethyl)-1H-pyridine-3-carboxamide (PubChem CID 103337389) has the molecular formula C14H15N3O2 and a molecular weight of 257.29 g/mol. Its IUPAC name is N-methyl-4-oxo-N-(2-pyridin-4-ylethyl)-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-4-oxo-N-(2-pyridin-4-ylethyl)-1H-pyridine-3-carboxamide
PubChem CID103337389
Molecular FormulaC14H15N3O2
Molecular Weight257.29 g/mol
Exact Mass257.12
IUPAC NameN-methyl-4-oxo-N-(2-pyridin-4-ylethyl)-1H-pyridine-3-carboxamide
SMILESCN(CCc1ccncc1)C(=O)c1c[nH]ccc1=O
InChIInChI=1S/C14H15N3O2/c1-17(9-5-11-2-6-15-7-3-11)14(19)12-10-16-8-4-13(12)18/h2-4,6-8,10H,5,9H2,1H3,(H,16,18)
InChIKeyXMADVNCFSHFXHN-UHFFFAOYSA-N
XLogP1.08
TPSA66.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-oxo-N-(2-pyridin-4-ylethyl)-1H-pyridine-3-carboxamide
CID 114039090
N-methyl-4-oxo-N-(3,3,3-trifluoropropyl)-1H-pyridine-3-carboxamide
CID 103337351
N-(2-cyanoethyl)-N-methyl-4-oxo-1H-pyridine-3-carboxamide
CID 103337352
N-(3-methoxypropyl)-N-methyl-4-oxo-1H-pyridine-3-carboxamide
CID 103337377
4-chloro-N-methyl-N-(2-pyridin-4-ylethyl)pyridine-3-carboxamide
CID 81226415
N,1,3-trimethyl-N-(2-pyridin-4-ylethyl)pyrazole-4-carboxamide
CID 110852590
N-methyl-N-(2-pyridin-4-ylethyl)pyrimidine-4-carboxamide
CID 110699109
N,2,4-trimethyl-N-(2-pyridin-4-ylethyl)pyrimidine-5-carboxamide
CID 110852637
N-methyl-5-oxo-N-(2-pyridin-4-ylethyl)-1,4-dihydropyrazole-3-carboxamide
CID 110467791
1-N-butyl-1-N,4-N-dimethyl-4-N-(2-pyridin-4-ylethyl)benzene-1,4-dicarboxamide
CID 109048088
N-methyl-N-(2-pyridin-4-ylethyl)-1,3-oxazole-4-carboxamide
CID 110689492
5-amino-2-fluoro-N-methyl-N-(2-pyridin-4-ylethyl)benzamide
CID 60913362

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-oxo-N-(2-pyridin-4-ylethyl)-1H-pyridine-3-carboxamide?
The IUPAC name of N-methyl-4-oxo-N-(2-pyridin-4-ylethyl)-1H-pyridine-3-carboxamide (CID 103337389) is N-methyl-4-oxo-N-(2-pyridin-4-ylethyl)-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-methyl-4-oxo-N-(2-pyridin-4-ylethyl)-1H-pyridine-3-carboxamide?
The canonical SMILES for N-methyl-4-oxo-N-(2-pyridin-4-ylethyl)-1H-pyridine-3-carboxamide is CN(CCc1ccncc1)C(=O)c1c[nH]ccc1=O.
What is the InChIKey of N-methyl-4-oxo-N-(2-pyridin-4-ylethyl)-1H-pyridine-3-carboxamide?
The InChIKey is XMADVNCFSHFXHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2/c1-17(9-5-11-2-6-15-7-3-11)14(19)12-10-16-8-4-13(12)18/h2-4,6-8,10H,5,9H2,1H3,(H,16,18).
What are the key properties of N-methyl-4-oxo-N-(2-pyridin-4-ylethyl)-1H-pyridine-3-carboxamide?
N-methyl-4-oxo-N-(2-pyridin-4-ylethyl)-1H-pyridine-3-carboxamide has a molecular weight of 257.29 g/mol, XLogP of 1.08, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-oxo-N-(2-pyridin-4-ylethyl)-1H-pyridine-3-carboxamide is sourced from PubChem (CID 103337389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).