N-(3-chlorophenyl)-6-(4-ethoxyanilino)pyridine-3-carboxamide

C20H18ClN3O2 — CID 109163439

IUPACN-(3-chlorophenyl)-6-(4-ethoxyanilino)pyridine-3-carboxamide
SMILESCCOc1ccc(Nc2ccc(C(=O)Nc3cccc(Cl)c3)cn2)cc1
InChIInChI=1S/C20H18ClN3O2/c1-2-26-18-9-7-16(8-10-18)23-19-11-6-14(13-22-19)20(25)24-17-5-3-4-15(21)12-17/h3-13H,2H2,1H3,(H,22,23)(H,24,25)
InChIKeyDQLBLFLUNPMSAN-UHFFFAOYSA-N
MW367.84 g/mol
LogP5.13
Rot. Bonds6

About N-(3-chlorophenyl)-6-(4-ethoxyanilino)pyridine-3-carboxamide

N-(3-chlorophenyl)-6-(4-ethoxyanilino)pyridine-3-carboxamide (PubChem CID 109163439) has the molecular formula C20H18ClN3O2 and a molecular weight of 367.84 g/mol. Its IUPAC name is N-(3-chlorophenyl)-6-(4-ethoxyanilino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-6-(4-ethoxyanilino)pyridine-3-carboxamide
PubChem CID109163439
Molecular FormulaC20H18ClN3O2
Molecular Weight367.84 g/mol
Exact Mass367.11
IUPAC NameN-(3-chlorophenyl)-6-(4-ethoxyanilino)pyridine-3-carboxamide
SMILESCCOc1ccc(Nc2ccc(C(=O)Nc3cccc(Cl)c3)cn2)cc1
InChIInChI=1S/C20H18ClN3O2/c1-2-26-18-9-7-16(8-10-18)23-19-11-6-14(13-22-19)20(25)24-17-5-3-4-15(21)12-17/h3-13H,2H2,1H3,(H,22,23)(H,24,25)
InChIKeyDQLBLFLUNPMSAN-UHFFFAOYSA-N
XLogP5.13
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500367.84
LogP ≤ 55.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-(4-acetylanilino)-N-(3-chlorophenyl)pyridine-3-carboxamide
CID 109163447
6-(4-acetamidoanilino)-N-(4-ethoxyphenyl)pyridine-3-carboxamide
CID 109164185
5-N-(3-chlorophenyl)-3-N-(4-ethoxyphenyl)pyridine-3,5-dicarboxamide
CID 109108789
N-(3,4-dimethoxyphenyl)-6-(4-ethoxyanilino)pyridine-3-carboxamide
CID 109164154
methyl 4-[[6-(3-chloroanilino)pyridine-3-carbonyl]amino]benzoate
CID 109163419
methyl 4-[[5-[(4-ethoxyphenyl)carbamoyl]-2-pyridinyl]amino]benzoate
CID 109164188
6-(3,4-difluoroanilino)-N-(4-ethoxyphenyl)pyridine-3-carboxamide
CID 109164202
6-[4-(dimethylamino)anilino]-N-(4-ethoxyphenyl)pyridine-3-carboxamide
CID 109164189
N-(2,3-dimethylphenyl)-6-(4-ethoxyanilino)pyridine-3-carboxamide
CID 109162787
N-[(4-chlorophenyl)methyl]-6-(4-ethoxyanilino)pyridine-3-carboxamide
CID 109157012
N-[(2-chlorophenyl)methyl]-6-(4-ethoxyanilino)pyridine-3-carboxamide
CID 109156873
N-(3-chlorophenyl)-4-propoxybenzamide
CID 4938336

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-6-(4-ethoxyanilino)pyridine-3-carboxamide?
The IUPAC name of N-(3-chlorophenyl)-6-(4-ethoxyanilino)pyridine-3-carboxamide (CID 109163439) is N-(3-chlorophenyl)-6-(4-ethoxyanilino)pyridine-3-carboxamide.
What is the SMILES notation for N-(3-chlorophenyl)-6-(4-ethoxyanilino)pyridine-3-carboxamide?
The canonical SMILES for N-(3-chlorophenyl)-6-(4-ethoxyanilino)pyridine-3-carboxamide is CCOc1ccc(Nc2ccc(C(=O)Nc3cccc(Cl)c3)cn2)cc1.
What is the InChIKey of N-(3-chlorophenyl)-6-(4-ethoxyanilino)pyridine-3-carboxamide?
The InChIKey is DQLBLFLUNPMSAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18ClN3O2/c1-2-26-18-9-7-16(8-10-18)23-19-11-6-14(13-22-19)20(25)24-17-5-3-4-15(21)12-17/h3-13H,2H2,1H3,(H,22,23)(H,24,25).
What are the key properties of N-(3-chlorophenyl)-6-(4-ethoxyanilino)pyridine-3-carboxamide?
N-(3-chlorophenyl)-6-(4-ethoxyanilino)pyridine-3-carboxamide has a molecular weight of 367.84 g/mol, XLogP of 5.13, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-6-(4-ethoxyanilino)pyridine-3-carboxamide is sourced from PubChem (CID 109163439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).