3-chloro-N-(3-cyanophenyl)-6-(ethylamino)pyridine-2-carboxamide

C15H13ClN4O — CID 62166201

IUPAC3-chloro-N-(3-cyanophenyl)-6-(ethylamino)pyridine-2-carboxamide
SMILESCCNc1ccc(Cl)c(C(=O)Nc2cccc(C#N)c2)n1
InChIInChI=1S/C15H13ClN4O/c1-2-18-13-7-6-12(16)14(20-13)15(21)19-11-5-3-4-10(8-11)9-17/h3-8H,2H2,1H3,(H,18,20)(H,19,21)
InChIKeyVZOVFNXKRQXNGW-UHFFFAOYSA-N
MW300.75 g/mol
LogP3.29
Rot. Bonds4

About 3-chloro-N-(3-cyanophenyl)-6-(ethylamino)pyridine-2-carboxamide

3-chloro-N-(3-cyanophenyl)-6-(ethylamino)pyridine-2-carboxamide (PubChem CID 62166201) has the molecular formula C15H13ClN4O and a molecular weight of 300.75 g/mol. Its IUPAC name is 3-chloro-N-(3-cyanophenyl)-6-(ethylamino)pyridine-2-carboxamide.

Molecular Properties

Compound Name3-chloro-N-(3-cyanophenyl)-6-(ethylamino)pyridine-2-carboxamide
PubChem CID62166201
Molecular FormulaC15H13ClN4O
Molecular Weight300.75 g/mol
Exact Mass300.08
IUPAC Name3-chloro-N-(3-cyanophenyl)-6-(ethylamino)pyridine-2-carboxamide
SMILESCCNc1ccc(Cl)c(C(=O)Nc2cccc(C#N)c2)n1
InChIInChI=1S/C15H13ClN4O/c1-2-18-13-7-6-12(16)14(20-13)15(21)19-11-5-3-4-10(8-11)9-17/h3-8H,2H2,1H3,(H,18,20)(H,19,21)
InChIKeyVZOVFNXKRQXNGW-UHFFFAOYSA-N
XLogP3.29
TPSA77.81 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.75
LogP ≤ 53.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-amino-3-chloro-N-(3-cyanophenyl)pyridine-2-carboxamide
CID 62156588
3,4,5,6-tetrachloro-N-(3-cyanophenyl)pyridine-2-carboxamide
CID 26727984
3-chloro-N-(2-chloro-5-methylphenyl)-6-(ethylamino)pyridine-2-carboxamide
CID 107631276
3-chloro-6-(ethylamino)-N-(2-iodophenyl)pyridine-2-carboxamide
CID 62167177
5-bromo-N-(3-cyanophenyl)-2-(ethylamino)pyridine-3-carboxamide
CID 62165850
6-N-(3-chlorophenyl)-2-N-(3-cyanophenyl)pyridine-2,6-dicarboxamide
CID 109100844
3-chloro-N-(4-chloro-2-iodophenyl)-6-(ethylamino)pyridine-2-carboxamide
CID 107631458
N-(3-chlorophenyl)-6-(ethylamino)pyridine-2-carboxamide
CID 62238582
2-chloro-N-(3-cyanophenyl)-5-(dimethylsulfamoyl)benzamide
CID 2707587
3-chloro-6-(ethylamino)-N-(2-propan-2-ylpyrazol-3-yl)pyridine-2-carboxamide
CID 62187265
N-(3-cyanophenyl)-6-[2-(4-methoxyphenoxy)ethylamino]pyrimidine-4-carboxamide
CID 109353666
N,N'-bis(3-cyanophenyl)-2,2-dimethylpropanediamide
CID 108970159

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-(3-cyanophenyl)-6-(ethylamino)pyridine-2-carboxamide?
The IUPAC name of 3-chloro-N-(3-cyanophenyl)-6-(ethylamino)pyridine-2-carboxamide (CID 62166201) is 3-chloro-N-(3-cyanophenyl)-6-(ethylamino)pyridine-2-carboxamide.
What is the SMILES notation for 3-chloro-N-(3-cyanophenyl)-6-(ethylamino)pyridine-2-carboxamide?
The canonical SMILES for 3-chloro-N-(3-cyanophenyl)-6-(ethylamino)pyridine-2-carboxamide is CCNc1ccc(Cl)c(C(=O)Nc2cccc(C#N)c2)n1.
What is the InChIKey of 3-chloro-N-(3-cyanophenyl)-6-(ethylamino)pyridine-2-carboxamide?
The InChIKey is VZOVFNXKRQXNGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClN4O/c1-2-18-13-7-6-12(16)14(20-13)15(21)19-11-5-3-4-10(8-11)9-17/h3-8H,2H2,1H3,(H,18,20)(H,19,21).
What are the key properties of 3-chloro-N-(3-cyanophenyl)-6-(ethylamino)pyridine-2-carboxamide?
3-chloro-N-(3-cyanophenyl)-6-(ethylamino)pyridine-2-carboxamide has a molecular weight of 300.75 g/mol, XLogP of 3.29, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-(3-cyanophenyl)-6-(ethylamino)pyridine-2-carboxamide is sourced from PubChem (CID 62166201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).