N-(2,6-dimethylphenyl)-5-(quinolin-8-ylamino)pyridine-2-carboxamide

C23H20N4O — CID 109198241

IUPACN-(2,6-dimethylphenyl)-5-(quinolin-8-ylamino)pyridine-2-carboxamide
SMILESCc1cccc(C)c1NC(=O)c1ccc(Nc2cccc3cccnc23)cn1
InChIInChI=1S/C23H20N4O/c1-15-6-3-7-16(2)21(15)27-23(28)20-12-11-18(14-25-20)26-19-10-4-8-17-9-5-13-24-22(17)19/h3-14,26H,1-2H3,(H,27,28)
InChIKeyRLEZISYPIRCUJJ-UHFFFAOYSA-N
MW368.44 g/mol
LogP5.24
Rot. Bonds4

About N-(2,6-dimethylphenyl)-5-(quinolin-8-ylamino)pyridine-2-carboxamide

N-(2,6-dimethylphenyl)-5-(quinolin-8-ylamino)pyridine-2-carboxamide (PubChem CID 109198241) has the molecular formula C23H20N4O and a molecular weight of 368.44 g/mol. Its IUPAC name is N-(2,6-dimethylphenyl)-5-(quinolin-8-ylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2,6-dimethylphenyl)-5-(quinolin-8-ylamino)pyridine-2-carboxamide
PubChem CID109198241
Molecular FormulaC23H20N4O
Molecular Weight368.44 g/mol
Exact Mass368.16
IUPAC NameN-(2,6-dimethylphenyl)-5-(quinolin-8-ylamino)pyridine-2-carboxamide
SMILESCc1cccc(C)c1NC(=O)c1ccc(Nc2cccc3cccnc23)cn1
InChIInChI=1S/C23H20N4O/c1-15-6-3-7-16(2)21(15)27-23(28)20-12-11-18(14-25-20)26-19-10-4-8-17-9-5-13-24-22(17)19/h3-14,26H,1-2H3,(H,27,28)
InChIKeyRLEZISYPIRCUJJ-UHFFFAOYSA-N
XLogP5.24
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500368.44
LogP ≤ 55.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,6-difluorophenyl)-5-(quinolin-8-ylamino)pyridine-2-carboxamide
CID 109200781
N-[4-(dimethylamino)phenyl]-5-(quinolin-8-ylamino)pyridine-2-carboxamide
CID 109200554
N-(5-methyl-1,2-oxazol-3-yl)-5-(quinolin-8-ylamino)pyridine-2-carboxamide
CID 109200783
5-(2-methoxyanilino)-N-quinolin-8-ylpyridine-2-carboxamide
CID 109199751
5-(methylamino)-N-quinolin-8-ylpyridine-2-carboxamide
CID 104639694
N-butyl-5-(quinolin-8-ylamino)pyridine-2-carboxamide
CID 109180787
6-(2,6-dimethylanilino)-N-quinolin-8-ylpyridazine-3-carboxamide
CID 109127790
5-(2,6-dimethylanilino)-N-quinolin-8-ylpyrazine-2-carboxamide
CID 109291330
N-(2,6-dimethylphenyl)-5-(4-methoxyanilino)pyridine-2-carboxamide
CID 109198223
5-(2-methylpropylamino)-N-quinolin-8-ylpyridine-2-carboxamide
CID 109181365
5-(butylamino)-N-quinolin-8-ylpyridine-2-carboxamide
CID 109180980
N-(3-chloro-4-methylphenyl)-6-(quinolin-8-ylamino)pyridazine-3-carboxamide
CID 109128991

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dimethylphenyl)-5-(quinolin-8-ylamino)pyridine-2-carboxamide?
The IUPAC name of N-(2,6-dimethylphenyl)-5-(quinolin-8-ylamino)pyridine-2-carboxamide (CID 109198241) is N-(2,6-dimethylphenyl)-5-(quinolin-8-ylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-(2,6-dimethylphenyl)-5-(quinolin-8-ylamino)pyridine-2-carboxamide?
The canonical SMILES for N-(2,6-dimethylphenyl)-5-(quinolin-8-ylamino)pyridine-2-carboxamide is Cc1cccc(C)c1NC(=O)c1ccc(Nc2cccc3cccnc23)cn1.
What is the InChIKey of N-(2,6-dimethylphenyl)-5-(quinolin-8-ylamino)pyridine-2-carboxamide?
The InChIKey is RLEZISYPIRCUJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N4O/c1-15-6-3-7-16(2)21(15)27-23(28)20-12-11-18(14-25-20)26-19-10-4-8-17-9-5-13-24-22(17)19/h3-14,26H,1-2H3,(H,27,28).
What are the key properties of N-(2,6-dimethylphenyl)-5-(quinolin-8-ylamino)pyridine-2-carboxamide?
N-(2,6-dimethylphenyl)-5-(quinolin-8-ylamino)pyridine-2-carboxamide has a molecular weight of 368.44 g/mol, XLogP of 5.24, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethylphenyl)-5-(quinolin-8-ylamino)pyridine-2-carboxamide is sourced from PubChem (CID 109198241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).