5-(3,5-dichloroanilino)-N-(3-methylphenyl)pyridine-3-carboxamide

C19H15Cl2N3O — CID 109241902

IUPAC5-(3,5-dichloroanilino)-N-(3-methylphenyl)pyridine-3-carboxamide
SMILESCc1cccc(NC(=O)c2cncc(Nc3cc(Cl)cc(Cl)c3)c2)c1
InChIInChI=1S/C19H15Cl2N3O/c1-12-3-2-4-16(5-12)24-19(25)13-6-18(11-22-10-13)23-17-8-14(20)7-15(21)9-17/h2-11,23H,1H3,(H,24,25)
InChIKeyCCOOURPGNVOOPK-UHFFFAOYSA-N
MW372.26 g/mol
LogP5.69
Rot. Bonds4

About 5-(3,5-dichloroanilino)-N-(3-methylphenyl)pyridine-3-carboxamide

5-(3,5-dichloroanilino)-N-(3-methylphenyl)pyridine-3-carboxamide (PubChem CID 109241902) has the molecular formula C19H15Cl2N3O and a molecular weight of 372.26 g/mol. Its IUPAC name is 5-(3,5-dichloroanilino)-N-(3-methylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-(3,5-dichloroanilino)-N-(3-methylphenyl)pyridine-3-carboxamide
PubChem CID109241902
Molecular FormulaC19H15Cl2N3O
Molecular Weight372.26 g/mol
Exact Mass371.06
IUPAC Name5-(3,5-dichloroanilino)-N-(3-methylphenyl)pyridine-3-carboxamide
SMILESCc1cccc(NC(=O)c2cncc(Nc3cc(Cl)cc(Cl)c3)c2)c1
InChIInChI=1S/C19H15Cl2N3O/c1-12-3-2-4-16(5-12)24-19(25)13-6-18(11-22-10-13)23-17-8-14(20)7-15(21)9-17/h2-11,23H,1H3,(H,24,25)
InChIKeyCCOOURPGNVOOPK-UHFFFAOYSA-N
XLogP5.69
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.26
LogP ≤ 55.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-(3-chloroanilino)-N-(3-chlorophenyl)pyridine-3-carboxamide
CID 109244464
N-(3,5-dichlorophenyl)-5-(4-methylanilino)pyridine-3-carboxamide
CID 109242174
N-(3-methylphenyl)-5-(4-propan-2-ylanilino)pyridine-3-carboxamide
CID 109241841
5-(4-acetylanilino)-N-(3-methylphenyl)pyridine-3-carboxamide
CID 109241874
5-(4-ethylanilino)-N-(3-methylphenyl)pyridine-3-carboxamide
CID 109241837
5-(2,5-dimethylanilino)-N-(3-methylphenyl)pyridine-3-carboxamide
CID 109241831
N-(3-methylphenyl)-5-[3-(trifluoromethyl)anilino]pyridine-3-carboxamide
CID 109241871
5-(2-bromoanilino)-N-(3-methylphenyl)pyridine-3-carboxamide
CID 109241887
N-(3-acetamidophenyl)-5-(4-chloroanilino)pyridine-3-carboxamide
CID 109244632
methyl 3-[[5-[(3-chlorophenyl)carbamoyl]-3-pyridinyl]amino]benzoate
CID 109244492
N-(3-chlorophenyl)-5-[(3-methylphenyl)methylamino]pyridine-3-carboxamide
CID 109232423
5-(3-acetamidoanilino)-N-(4-chlorophenyl)pyridine-3-carboxamide
CID 109244585

Frequently Asked Questions

What is the IUPAC name of 5-(3,5-dichloroanilino)-N-(3-methylphenyl)pyridine-3-carboxamide?
The IUPAC name of 5-(3,5-dichloroanilino)-N-(3-methylphenyl)pyridine-3-carboxamide (CID 109241902) is 5-(3,5-dichloroanilino)-N-(3-methylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 5-(3,5-dichloroanilino)-N-(3-methylphenyl)pyridine-3-carboxamide?
The canonical SMILES for 5-(3,5-dichloroanilino)-N-(3-methylphenyl)pyridine-3-carboxamide is Cc1cccc(NC(=O)c2cncc(Nc3cc(Cl)cc(Cl)c3)c2)c1.
What is the InChIKey of 5-(3,5-dichloroanilino)-N-(3-methylphenyl)pyridine-3-carboxamide?
The InChIKey is CCOOURPGNVOOPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15Cl2N3O/c1-12-3-2-4-16(5-12)24-19(25)13-6-18(11-22-10-13)23-17-8-14(20)7-15(21)9-17/h2-11,23H,1H3,(H,24,25).
What are the key properties of 5-(3,5-dichloroanilino)-N-(3-methylphenyl)pyridine-3-carboxamide?
5-(3,5-dichloroanilino)-N-(3-methylphenyl)pyridine-3-carboxamide has a molecular weight of 372.26 g/mol, XLogP of 5.69, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3,5-dichloroanilino)-N-(3-methylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 109241902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).