N-(3,4-dichlorophenyl)-5-(methylamino)pyridine-2-carboxamide

C13H11Cl2N3O — CID 104639765

IUPACN-(3,4-dichlorophenyl)-5-(methylamino)pyridine-2-carboxamide
SMILESCNc1ccc(C(=O)Nc2ccc(Cl)c(Cl)c2)nc1
InChIInChI=1S/C13H11Cl2N3O/c1-16-9-3-5-12(17-7-9)13(19)18-8-2-4-10(14)11(15)6-8/h2-7,16H,1H3,(H,18,19)
InChIKeyJQXDZSDEYVEWIK-UHFFFAOYSA-N
MW296.16 g/mol
LogP3.68
Rot. Bonds3

About N-(3,4-dichlorophenyl)-5-(methylamino)pyridine-2-carboxamide

N-(3,4-dichlorophenyl)-5-(methylamino)pyridine-2-carboxamide (PubChem CID 104639765) has the molecular formula C13H11Cl2N3O and a molecular weight of 296.16 g/mol. Its IUPAC name is N-(3,4-dichlorophenyl)-5-(methylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(3,4-dichlorophenyl)-5-(methylamino)pyridine-2-carboxamide
PubChem CID104639765
Molecular FormulaC13H11Cl2N3O
Molecular Weight296.16 g/mol
Exact Mass295.03
IUPAC NameN-(3,4-dichlorophenyl)-5-(methylamino)pyridine-2-carboxamide
SMILESCNc1ccc(C(=O)Nc2ccc(Cl)c(Cl)c2)nc1
InChIInChI=1S/C13H11Cl2N3O/c1-16-9-3-5-12(17-7-9)13(19)18-8-2-4-10(14)11(15)6-8/h2-7,16H,1H3,(H,18,19)
InChIKeyJQXDZSDEYVEWIK-UHFFFAOYSA-N
XLogP3.68
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.16
LogP ≤ 53.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3,5-dichlorophenyl)-5-(methylamino)pyridine-2-carboxamide
CID 104639754
N-(3,4-dichlorophenyl)-5-(2-methylpropylamino)pyridine-2-carboxamide
CID 109181373
5-(butan-2-ylamino)-N-(3,4-dichlorophenyl)pyridine-2-carboxamide
CID 109181756
N-(3,4-dichlorophenyl)-5-(3-methylbutylamino)pyridine-2-carboxamide
CID 109195700
N-(3-methoxyphenyl)-5-(methylamino)pyridine-2-carboxamide
CID 104640036
5-(cyclohexylamino)-N-(3,4-dichlorophenyl)pyridine-2-carboxamide
CID 109183218
N-(3-bromo-5-methylphenyl)-5-(methylamino)pyridine-2-carboxamide
CID 107578475
5-chloro-N-(3,4-dichlorophenyl)-2-(methylamino)pyridine-4-carboxamide
CID 114921560
5-N-(3,4-dichlorophenyl)pyridine-2,5-dicarboxamide
CID 47460215
N-(1,3-benzothiazol-6-yl)-5-(methylamino)pyridine-2-carboxamide
CID 107801394
N-(3,4-dichlorophenyl)-5-(furan-2-ylmethylamino)pyridine-2-carboxamide
CID 109187803
N-(5-chloro-2-pyridinyl)-5-(methylamino)pyridine-2-carboxamide
CID 104640066

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dichlorophenyl)-5-(methylamino)pyridine-2-carboxamide?
The IUPAC name of N-(3,4-dichlorophenyl)-5-(methylamino)pyridine-2-carboxamide (CID 104639765) is N-(3,4-dichlorophenyl)-5-(methylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-(3,4-dichlorophenyl)-5-(methylamino)pyridine-2-carboxamide?
The canonical SMILES for N-(3,4-dichlorophenyl)-5-(methylamino)pyridine-2-carboxamide is CNc1ccc(C(=O)Nc2ccc(Cl)c(Cl)c2)nc1.
What is the InChIKey of N-(3,4-dichlorophenyl)-5-(methylamino)pyridine-2-carboxamide?
The InChIKey is JQXDZSDEYVEWIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11Cl2N3O/c1-16-9-3-5-12(17-7-9)13(19)18-8-2-4-10(14)11(15)6-8/h2-7,16H,1H3,(H,18,19).
What are the key properties of N-(3,4-dichlorophenyl)-5-(methylamino)pyridine-2-carboxamide?
N-(3,4-dichlorophenyl)-5-(methylamino)pyridine-2-carboxamide has a molecular weight of 296.16 g/mol, XLogP of 3.68, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dichlorophenyl)-5-(methylamino)pyridine-2-carboxamide is sourced from PubChem (CID 104639765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).