N-[2-(4-chlorophenoxy)ethyl]-N,1-dimethyl-2-oxopyridine-4-carboxamide

C16H17ClN2O3 — CID 35691977

IUPACN-[2-(4-chlorophenoxy)ethyl]-N,1-dimethyl-2-oxopyridine-4-carboxamide
SMILESCN(CCOc1ccc(Cl)cc1)C(=O)c1ccn(C)c(=O)c1
InChIInChI=1S/C16H17ClN2O3/c1-18-8-7-12(11-15(18)20)16(21)19(2)9-10-22-14-5-3-13(17)4-6-14/h3-8,11H,9-10H2,1-2H3
InChIKeyMNRJCSFTATWCES-UHFFFAOYSA-N
MW320.78 g/mol
LogP2.19
Rot. Bonds5

About N-[2-(4-chlorophenoxy)ethyl]-N,1-dimethyl-2-oxopyridine-4-carboxamide

N-[2-(4-chlorophenoxy)ethyl]-N,1-dimethyl-2-oxopyridine-4-carboxamide (PubChem CID 35691977) has the molecular formula C16H17ClN2O3 and a molecular weight of 320.78 g/mol. Its IUPAC name is N-[2-(4-chlorophenoxy)ethyl]-N,1-dimethyl-2-oxopyridine-4-carboxamide.

Molecular Properties

Compound NameN-[2-(4-chlorophenoxy)ethyl]-N,1-dimethyl-2-oxopyridine-4-carboxamide
PubChem CID35691977
Molecular FormulaC16H17ClN2O3
Molecular Weight320.78 g/mol
Exact Mass320.09
IUPAC NameN-[2-(4-chlorophenoxy)ethyl]-N,1-dimethyl-2-oxopyridine-4-carboxamide
SMILESCN(CCOc1ccc(Cl)cc1)C(=O)c1ccn(C)c(=O)c1
InChIInChI=1S/C16H17ClN2O3/c1-18-8-7-12(11-15(18)20)16(21)19(2)9-10-22-14-5-3-13(17)4-6-14/h3-8,11H,9-10H2,1-2H3
InChIKeyMNRJCSFTATWCES-UHFFFAOYSA-N
XLogP2.19
TPSA51.54 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.78
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(4-chlorophenoxy)ethyl]-N,3,4-trimethylbenzamide
CID 112792740
4-bromo-N-[2-(4-chlorophenoxy)ethyl]-3-fluoro-N-methylbenzamide
CID 60589214
N-[2-(4-chlorophenoxy)ethyl]-4-ethyl-N-methylbenzamide
CID 112792734
N-[3-(4-chlorophenoxy)propyl]-N,2-dimethyl-1,3-dioxoisoindole-5-carboxamide
CID 55898733
N-[2-(4-chlorophenoxy)ethyl]-N,1,2-trimethylbenzimidazole-5-carboxamide
CID 71934907
N-ethyl-N,1-dimethyl-2-oxopyridine-4-carboxamide
CID 103612566
4-chloro-N-[2-(4-chlorophenoxy)ethyl]-N-methyl-3-methylsulfonylbenzamide
CID 31289866
2-bromo-N-[2-(4-chlorophenoxy)ethyl]-N,2-dimethylpropanamide
CID 115649486
N-(3-amino-3-sulfanylidenepropyl)-N,1-dimethyl-2-oxopyridine-4-carboxamide
CID 114039702
4-amino-N-[2-(4-chlorophenoxy)ethyl]-N-methyl-3-nitrobenzamide
CID 27795603
N-[2-(4-chlorophenoxy)ethyl]-3-(methanesulfonamido)-N-methylbenzamide
CID 31470074
4-chloro-N-[4-[[2-(4-chlorophenoxy)ethyl-methylcarbamoyl]amino]phenyl]-N-methylbenzamide
CID 60577621

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-chlorophenoxy)ethyl]-N,1-dimethyl-2-oxopyridine-4-carboxamide?
The IUPAC name of N-[2-(4-chlorophenoxy)ethyl]-N,1-dimethyl-2-oxopyridine-4-carboxamide (CID 35691977) is N-[2-(4-chlorophenoxy)ethyl]-N,1-dimethyl-2-oxopyridine-4-carboxamide.
What is the SMILES notation for N-[2-(4-chlorophenoxy)ethyl]-N,1-dimethyl-2-oxopyridine-4-carboxamide?
The canonical SMILES for N-[2-(4-chlorophenoxy)ethyl]-N,1-dimethyl-2-oxopyridine-4-carboxamide is CN(CCOc1ccc(Cl)cc1)C(=O)c1ccn(C)c(=O)c1.
What is the InChIKey of N-[2-(4-chlorophenoxy)ethyl]-N,1-dimethyl-2-oxopyridine-4-carboxamide?
The InChIKey is MNRJCSFTATWCES-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClN2O3/c1-18-8-7-12(11-15(18)20)16(21)19(2)9-10-22-14-5-3-13(17)4-6-14/h3-8,11H,9-10H2,1-2H3.
What are the key properties of N-[2-(4-chlorophenoxy)ethyl]-N,1-dimethyl-2-oxopyridine-4-carboxamide?
N-[2-(4-chlorophenoxy)ethyl]-N,1-dimethyl-2-oxopyridine-4-carboxamide has a molecular weight of 320.78 g/mol, XLogP of 2.19, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-chlorophenoxy)ethyl]-N,1-dimethyl-2-oxopyridine-4-carboxamide is sourced from PubChem (CID 35691977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).