4-[2-(3-chlorophenyl)ethylamino]-N-(2-methoxyphenyl)pyridine-2-carboxamide

C21H20ClN3O2 — CID 109218513

IUPAC4-[2-(3-chlorophenyl)ethylamino]-N-(2-methoxyphenyl)pyridine-2-carboxamide
SMILESCOc1ccccc1NC(=O)c1cc(NCCc2cccc(Cl)c2)ccn1
InChIInChI=1S/C21H20ClN3O2/c1-27-20-8-3-2-7-18(20)25-21(26)19-14-17(10-12-24-19)23-11-9-15-5-4-6-16(22)13-15/h2-8,10,12-14H,9,11H2,1H3,(H,23,24)(H,25,26)
InChIKeyMOUUXEYVOFWPKW-UHFFFAOYSA-N
MW381.86 g/mol
LogP4.65
Rot. Bonds7

About 4-[2-(3-chlorophenyl)ethylamino]-N-(2-methoxyphenyl)pyridine-2-carboxamide

4-[2-(3-chlorophenyl)ethylamino]-N-(2-methoxyphenyl)pyridine-2-carboxamide (PubChem CID 109218513) has the molecular formula C21H20ClN3O2 and a molecular weight of 381.86 g/mol. Its IUPAC name is 4-[2-(3-chlorophenyl)ethylamino]-N-(2-methoxyphenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name4-[2-(3-chlorophenyl)ethylamino]-N-(2-methoxyphenyl)pyridine-2-carboxamide
PubChem CID109218513
Molecular FormulaC21H20ClN3O2
Molecular Weight381.86 g/mol
Exact Mass381.12
IUPAC Name4-[2-(3-chlorophenyl)ethylamino]-N-(2-methoxyphenyl)pyridine-2-carboxamide
SMILESCOc1ccccc1NC(=O)c1cc(NCCc2cccc(Cl)c2)ccn1
InChIInChI=1S/C21H20ClN3O2/c1-27-20-8-3-2-7-18(20)25-21(26)19-14-17(10-12-24-19)23-11-9-15-5-4-6-16(22)13-15/h2-8,10,12-14H,9,11H2,1H3,(H,23,24)(H,25,26)
InChIKeyMOUUXEYVOFWPKW-UHFFFAOYSA-N
XLogP4.65
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.86
LogP ≤ 54.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methoxy-5-methylphenyl)-4-(2-phenylethylamino)pyridine-2-carboxamide
CID 109213702
4-[2-(3-chlorophenyl)ethylamino]-N-(4-fluorophenyl)pyridine-2-carboxamide
CID 109218509
2-[2-(3-chlorophenyl)ethylamino]-N-(2-methoxyphenyl)-6-methylpyrimidine-4-carboxamide
CID 109334311
N-(5-chloro-2-methoxyphenyl)-4-[2-(2-fluorophenyl)ethylamino]pyridine-2-carboxamide
CID 109214065
N-(2-ethylphenyl)-4-[2-(3-methoxyphenyl)ethylamino]pyridine-2-carboxamide
CID 109214474
4-[2-(3-chlorophenyl)ethylamino]-N-(2-methylpropyl)pyridine-2-carboxamide
CID 109202931
N-[2-(3-chlorophenyl)ethyl]-4-(2-methoxy-5-methylanilino)pyridine-2-carboxamide
CID 109218487
4-[2-(3-chlorophenyl)ethylamino]-N-[2-(4-fluorophenyl)ethyl]pyridine-2-carboxamide
CID 109214119
N-(4-chlorophenyl)-4-[2-(2-methoxyphenyl)ethylamino]pyridine-2-carboxamide
CID 109214357
N-[2-(3-chlorophenyl)ethyl]-4-(2-ethoxyanilino)pyridine-2-carboxamide
CID 109218485
4-[2-(4-fluorophenyl)ethylamino]-N-(2-propan-2-yloxyphenyl)pyridine-2-carboxamide
CID 109214232
4-[2-(4-chlorophenyl)ethylamino]-N-(2-methylphenyl)pyridine-2-carboxamide
CID 109215473

Frequently Asked Questions

What is the IUPAC name of 4-[2-(3-chlorophenyl)ethylamino]-N-(2-methoxyphenyl)pyridine-2-carboxamide?
The IUPAC name of 4-[2-(3-chlorophenyl)ethylamino]-N-(2-methoxyphenyl)pyridine-2-carboxamide (CID 109218513) is 4-[2-(3-chlorophenyl)ethylamino]-N-(2-methoxyphenyl)pyridine-2-carboxamide.
What is the SMILES notation for 4-[2-(3-chlorophenyl)ethylamino]-N-(2-methoxyphenyl)pyridine-2-carboxamide?
The canonical SMILES for 4-[2-(3-chlorophenyl)ethylamino]-N-(2-methoxyphenyl)pyridine-2-carboxamide is COc1ccccc1NC(=O)c1cc(NCCc2cccc(Cl)c2)ccn1.
What is the InChIKey of 4-[2-(3-chlorophenyl)ethylamino]-N-(2-methoxyphenyl)pyridine-2-carboxamide?
The InChIKey is MOUUXEYVOFWPKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20ClN3O2/c1-27-20-8-3-2-7-18(20)25-21(26)19-14-17(10-12-24-19)23-11-9-15-5-4-6-16(22)13-15/h2-8,10,12-14H,9,11H2,1H3,(H,23,24)(H,25,26).
What are the key properties of 4-[2-(3-chlorophenyl)ethylamino]-N-(2-methoxyphenyl)pyridine-2-carboxamide?
4-[2-(3-chlorophenyl)ethylamino]-N-(2-methoxyphenyl)pyridine-2-carboxamide has a molecular weight of 381.86 g/mol, XLogP of 4.65, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(3-chlorophenyl)ethylamino]-N-(2-methoxyphenyl)pyridine-2-carboxamide is sourced from PubChem (CID 109218513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).