N-[2-(ethylaminomethyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide

C16H19N3O2 — CID 103793628

IUPACN-[2-(ethylaminomethyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide
SMILESCCNCc1ccccc1NC(=O)c1ccn(C)c(=O)c1
InChIInChI=1S/C16H19N3O2/c1-3-17-11-13-6-4-5-7-14(13)18-16(21)12-8-9-19(2)15(20)10-12/h4-10,17H,3,11H2,1-2H3,(H,18,21)
InChIKeyRATGJYSSFUUPDO-UHFFFAOYSA-N
MW285.35 g/mol
LogP1.75
Rot. Bonds5

About N-[2-(ethylaminomethyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide

N-[2-(ethylaminomethyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide (PubChem CID 103793628) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is N-[2-(ethylaminomethyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide.

Molecular Properties

Compound NameN-[2-(ethylaminomethyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide
PubChem CID103793628
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC NameN-[2-(ethylaminomethyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide
SMILESCCNCc1ccccc1NC(=O)c1ccn(C)c(=O)c1
InChIInChI=1S/C16H19N3O2/c1-3-17-11-13-6-4-5-7-14(13)18-16(21)12-8-9-19(2)15(20)10-12/h4-10,17H,3,11H2,1-2H3,(H,18,21)
InChIKeyRATGJYSSFUUPDO-UHFFFAOYSA-N
XLogP1.75
TPSA63.13 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-methyl-2-oxo-N-(2-propylphenyl)pyridine-4-carboxamide
CID 31870618
N-[2-(ethylaminomethyl)phenyl]-2-oxo-1H-pyridine-4-carboxamide
CID 103805548
N-[2-(ethylaminomethyl)phenyl]-1-methylpyrrole-2-carboxamide
CID 43601475
N-[2-(ethylaminomethyl)phenyl]-3,5-dimethylbenzamide
CID 43601336
3-bromo-N-[2-(ethylaminomethyl)phenyl]-4-methylbenzamide
CID 81459743
N-[2-(ethylaminomethyl)phenyl]-3,4-dimethylbenzamide;hydrochloride
CID 119440699
3,5-dichloro-N-[2-(ethylaminomethyl)phenyl]benzamide
CID 43601335
3,4-diethoxy-N-[2-(ethylaminomethyl)phenyl]benzamide
CID 119438964
4-acetyl-N-[2-(ethylaminomethyl)phenyl]benzamide;hydrochloride
CID 86779920
3-(dimethylcarbamoylamino)-N-[2-(ethylaminomethyl)phenyl]benzamide
CID 119440210
N-[2-(ethylaminomethyl)phenyl]-3,5-dimethoxybenzamide
CID 119438730
1-N-[2-(ethylaminomethyl)phenyl]-3-N,3-N-dipropylbenzene-1,3-dicarboxamide;hydrochloride
CID 119439486

Frequently Asked Questions

What is the IUPAC name of N-[2-(ethylaminomethyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide?
The IUPAC name of N-[2-(ethylaminomethyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide (CID 103793628) is N-[2-(ethylaminomethyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide.
What is the SMILES notation for N-[2-(ethylaminomethyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide?
The canonical SMILES for N-[2-(ethylaminomethyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide is CCNCc1ccccc1NC(=O)c1ccn(C)c(=O)c1.
What is the InChIKey of N-[2-(ethylaminomethyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide?
The InChIKey is RATGJYSSFUUPDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-3-17-11-13-6-4-5-7-14(13)18-16(21)12-8-9-19(2)15(20)10-12/h4-10,17H,3,11H2,1-2H3,(H,18,21).
What are the key properties of N-[2-(ethylaminomethyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide?
N-[2-(ethylaminomethyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide has a molecular weight of 285.35 g/mol, XLogP of 1.75, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(ethylaminomethyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide is sourced from PubChem (CID 103793628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).