N-(2-chlorophenyl)-4-(4-ethoxyanilino)pyridine-2-carboxamide

C20H18ClN3O2 — CID 109220864

IUPACN-(2-chlorophenyl)-4-(4-ethoxyanilino)pyridine-2-carboxamide
SMILESCCOc1ccc(Nc2ccnc(C(=O)Nc3ccccc3Cl)c2)cc1
InChIInChI=1S/C20H18ClN3O2/c1-2-26-16-9-7-14(8-10-16)23-15-11-12-22-19(13-15)20(25)24-18-6-4-3-5-17(18)21/h3-13H,2H2,1H3,(H,22,23)(H,24,25)
InChIKeyHGLXKQHERWKIRA-UHFFFAOYSA-N
MW367.84 g/mol
LogP5.13
Rot. Bonds6

About N-(2-chlorophenyl)-4-(4-ethoxyanilino)pyridine-2-carboxamide

N-(2-chlorophenyl)-4-(4-ethoxyanilino)pyridine-2-carboxamide (PubChem CID 109220864) has the molecular formula C20H18ClN3O2 and a molecular weight of 367.84 g/mol. Its IUPAC name is N-(2-chlorophenyl)-4-(4-ethoxyanilino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-4-(4-ethoxyanilino)pyridine-2-carboxamide
PubChem CID109220864
Molecular FormulaC20H18ClN3O2
Molecular Weight367.84 g/mol
Exact Mass367.11
IUPAC NameN-(2-chlorophenyl)-4-(4-ethoxyanilino)pyridine-2-carboxamide
SMILESCCOc1ccc(Nc2ccnc(C(=O)Nc3ccccc3Cl)c2)cc1
InChIInChI=1S/C20H18ClN3O2/c1-2-26-16-9-7-14(8-10-16)23-15-11-12-22-19(13-15)20(25)24-18-6-4-3-5-17(18)21/h3-13H,2H2,1H3,(H,22,23)(H,24,25)
InChIKeyHGLXKQHERWKIRA-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

2-N-(2-chlorophenyl)-4-N-(4-ethoxyphenyl)pyridine-2,4-dicarboxamide
CID 109092798
ethyl 2-[[2-[(2-chlorophenyl)carbamoyl]-4-pyridinyl]amino]benzoate
CID 109220888
N-(4-ethoxyphenyl)-4-(2-propan-2-ylanilino)pyridine-2-carboxamide
CID 109220430
4-(3-acetamidoanilino)-N-(2-chlorophenyl)pyridine-2-carboxamide
CID 109220873
4-(3-chloro-4-methoxyanilino)-N-(4-ethoxyphenyl)pyridine-2-carboxamide
CID 109221380
4-(3,4-dimethylanilino)-N-(4-ethoxyphenyl)pyridine-2-carboxamide
CID 109219903
4-(4-ethoxyanilino)pyridine-2-carboxylic acid
CID 43326061
N-(2-fluorophenyl)-4-(4-methoxyanilino)pyridine-2-carboxamide
CID 109220605
N-(4-chlorophenyl)-4-(2-ethoxyanilino)pyridine-2-carboxamide
CID 109221025
4-(4-ethoxyanilino)-N-[(2-fluorophenyl)methyl]pyridine-2-carboxamide
CID 109211207
4-(2,4-dimethylanilino)-N-(4-ethoxyphenyl)pyridine-2-carboxamide
CID 109219771
N-(2-tert-butylphenyl)-4-(4-methoxyanilino)pyridine-2-carboxamide
CID 109220552

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-4-(4-ethoxyanilino)pyridine-2-carboxamide?
The IUPAC name of N-(2-chlorophenyl)-4-(4-ethoxyanilino)pyridine-2-carboxamide (CID 109220864) is N-(2-chlorophenyl)-4-(4-ethoxyanilino)pyridine-2-carboxamide.
What is the SMILES notation for N-(2-chlorophenyl)-4-(4-ethoxyanilino)pyridine-2-carboxamide?
The canonical SMILES for N-(2-chlorophenyl)-4-(4-ethoxyanilino)pyridine-2-carboxamide is CCOc1ccc(Nc2ccnc(C(=O)Nc3ccccc3Cl)c2)cc1.
What is the InChIKey of N-(2-chlorophenyl)-4-(4-ethoxyanilino)pyridine-2-carboxamide?
The InChIKey is HGLXKQHERWKIRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18ClN3O2/c1-2-26-16-9-7-14(8-10-16)23-15-11-12-22-19(13-15)20(25)24-18-6-4-3-5-17(18)21/h3-13H,2H2,1H3,(H,22,23)(H,24,25).
What are the key properties of N-(2-chlorophenyl)-4-(4-ethoxyanilino)pyridine-2-carboxamide?
N-(2-chlorophenyl)-4-(4-ethoxyanilino)pyridine-2-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-(2-chlorophenyl)-4-(4-ethoxyanilino)pyridine-2-carboxamide is sourced from PubChem (CID 109220864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).