5-chloro-N-[2-(2,6-dichlorophenoxy)ethyl]-N-ethylpyridine-3-carboxamide

C16H15Cl3N2O2 — CID 70462625

IUPAC5-chloro-N-[2-(2,6-dichlorophenoxy)ethyl]-N-ethylpyridine-3-carboxamide
SMILESCCN(CCOc1c(Cl)cccc1Cl)C(=O)c1cncc(Cl)c1
InChIInChI=1S/C16H15Cl3N2O2/c1-2-21(16(22)11-8-12(17)10-20-9-11)6-7-23-15-13(18)4-3-5-14(15)19/h3-5,8-10H,2,6-7H2,1H3
InChIKeyFWXNHRRTTAOALY-UHFFFAOYSA-N
MW373.67 g/mol
LogP4.58
Rot. Bonds6

About 5-chloro-N-[2-(2,6-dichlorophenoxy)ethyl]-N-ethylpyridine-3-carboxamide

5-chloro-N-[2-(2,6-dichlorophenoxy)ethyl]-N-ethylpyridine-3-carboxamide (PubChem CID 70462625) has the molecular formula C16H15Cl3N2O2 and a molecular weight of 373.67 g/mol. Its IUPAC name is 5-chloro-N-[2-(2,6-dichlorophenoxy)ethyl]-N-ethylpyridine-3-carboxamide.

Molecular Properties

Compound Name5-chloro-N-[2-(2,6-dichlorophenoxy)ethyl]-N-ethylpyridine-3-carboxamide
PubChem CID70462625
Molecular FormulaC16H15Cl3N2O2
Molecular Weight373.67 g/mol
Exact Mass372.02
IUPAC Name5-chloro-N-[2-(2,6-dichlorophenoxy)ethyl]-N-ethylpyridine-3-carboxamide
SMILESCCN(CCOc1c(Cl)cccc1Cl)C(=O)c1cncc(Cl)c1
InChIInChI=1S/C16H15Cl3N2O2/c1-2-21(16(22)11-8-12(17)10-20-9-11)6-7-23-15-13(18)4-3-5-14(15)19/h3-5,8-10H,2,6-7H2,1H3
InChIKeyFWXNHRRTTAOALY-UHFFFAOYSA-N
XLogP4.58
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.67
LogP ≤ 54.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]pyridine-3-carboxamide
CID 70461907
5-chloro-N-(2-hydroxyethyl)-N-propylpyridine-3-carboxamide
CID 70463058
5-chloro-N-[2-(dimethylamino)ethyl]-N-methylpyridine-3-carboxamide
CID 175903314
N-ethyl-5-hydroxy-N-[2-(2-hydroxyethoxy)ethyl]pyridine-3-carboxamide
CID 114263707
5-(2,3-dichloroanilino)-N,N-dipropylpyridine-3-carboxamide
CID 109241006
5-[4-(3-chlorophenyl)piperazin-1-yl]-N,N-diethylpyridine-3-carboxamide
CID 109238491
N-(2-bromoethyl)-3-chloro-N-ethylbenzamide
CID 80661039
3-[5-[ethyl(2-methoxyethyl)carbamoyl]-3-pyridinyl]prop-2-enoic acid
CID 76909118
5-bromo-N-[2-(2,4-dichloro-6-methylphenoxy)ethyl]-N-methylpyridine-3-carboxamide
CID 70461703
N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]pyrazine-2-carboxamide
CID 13488358
N-ethyl-N-(2-hydroxyethyl)-5-phenylpyridine-3-carboxamide
CID 109468089
N-ethyl-5-hydroxy-N-(2-hydroxyethyl)pyridine-3-carboxamide
CID 63850012

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[2-(2,6-dichlorophenoxy)ethyl]-N-ethylpyridine-3-carboxamide?
The IUPAC name of 5-chloro-N-[2-(2,6-dichlorophenoxy)ethyl]-N-ethylpyridine-3-carboxamide (CID 70462625) is 5-chloro-N-[2-(2,6-dichlorophenoxy)ethyl]-N-ethylpyridine-3-carboxamide.
What is the SMILES notation for 5-chloro-N-[2-(2,6-dichlorophenoxy)ethyl]-N-ethylpyridine-3-carboxamide?
The canonical SMILES for 5-chloro-N-[2-(2,6-dichlorophenoxy)ethyl]-N-ethylpyridine-3-carboxamide is CCN(CCOc1c(Cl)cccc1Cl)C(=O)c1cncc(Cl)c1.
What is the InChIKey of 5-chloro-N-[2-(2,6-dichlorophenoxy)ethyl]-N-ethylpyridine-3-carboxamide?
The InChIKey is FWXNHRRTTAOALY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15Cl3N2O2/c1-2-21(16(22)11-8-12(17)10-20-9-11)6-7-23-15-13(18)4-3-5-14(15)19/h3-5,8-10H,2,6-7H2,1H3.
What are the key properties of 5-chloro-N-[2-(2,6-dichlorophenoxy)ethyl]-N-ethylpyridine-3-carboxamide?
5-chloro-N-[2-(2,6-dichlorophenoxy)ethyl]-N-ethylpyridine-3-carboxamide has a molecular weight of 373.67 g/mol, XLogP of 4.58, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[2-(2,6-dichlorophenoxy)ethyl]-N-ethylpyridine-3-carboxamide is sourced from PubChem (CID 70462625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).