N-[6-(dimethylamino)-3-pyridinyl]-2-pyridin-3-ylquinoline-4-carboxamide

C22H19N5O — CID 30294376

IUPACN-[6-(dimethylamino)-3-pyridinyl]-2-pyridin-3-ylquinoline-4-carboxamide
SMILESCN(C)c1ccc(NC(=O)c2cc(-c3cccnc3)nc3ccccc23)cn1
InChIInChI=1S/C22H19N5O/c1-27(2)21-10-9-16(14-24-21)25-22(28)18-12-20(15-6-5-11-23-13-15)26-19-8-4-3-7-17(18)19/h3-14H,1-2H3,(H,25,28)
InChIKeyBUZXEAOMUXDMIJ-UHFFFAOYSA-N
MW369.43 g/mol
LogP4.01
Rot. Bonds4

About N-[6-(dimethylamino)-3-pyridinyl]-2-pyridin-3-ylquinoline-4-carboxamide

N-[6-(dimethylamino)-3-pyridinyl]-2-pyridin-3-ylquinoline-4-carboxamide (PubChem CID 30294376) has the molecular formula C22H19N5O and a molecular weight of 369.43 g/mol. Its IUPAC name is N-[6-(dimethylamino)-3-pyridinyl]-2-pyridin-3-ylquinoline-4-carboxamide.

Molecular Properties

Compound NameN-[6-(dimethylamino)-3-pyridinyl]-2-pyridin-3-ylquinoline-4-carboxamide
PubChem CID30294376
Molecular FormulaC22H19N5O
Molecular Weight369.43 g/mol
Exact Mass369.16
IUPAC NameN-[6-(dimethylamino)-3-pyridinyl]-2-pyridin-3-ylquinoline-4-carboxamide
SMILESCN(C)c1ccc(NC(=O)c2cc(-c3cccnc3)nc3ccccc23)cn1
InChIInChI=1S/C22H19N5O/c1-27(2)21-10-9-16(14-24-21)25-22(28)18-12-20(15-6-5-11-23-13-15)26-19-8-4-3-7-17(18)19/h3-14H,1-2H3,(H,25,28)
InChIKeyBUZXEAOMUXDMIJ-UHFFFAOYSA-N
XLogP4.01
TPSA71.01 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.43
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-hydroxyphenyl)-2-pyridin-3-ylquinoline-4-carboxamide
CID 39311131
2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[6-(dimethylamino)-3-pyridinyl]quinoline-4-carboxamide
CID 46536558
N-[6-(benzimidazol-1-yl)-3-pyridinyl]-2-pyridin-3-ylquinoline-4-carboxamide
CID 56566302
N-(6-piperidin-1-yl-3-pyridinyl)-2-pyridin-3-ylquinoline-4-carboxamide
CID 24612164
N-methyl-2-pyridin-3-ylquinoline-4-carboxamide
CID 53007972
N-(3-fluoro-4-methoxyphenyl)-2-pyridin-3-ylquinoline-4-carboxamide
CID 55868418
N-(2-hydroxyphenyl)-2-pyridin-3-ylquinoline-4-carboxamide
CID 39889991
N-[4-[2-oxo-2-(propan-2-ylamino)ethyl]phenyl]-2-pyridin-3-ylquinoline-4-carboxamide
CID 55619404
N-[4-(cyclopentylcarbamoyl)phenyl]-2-pyridin-3-ylquinoline-4-carboxamide
CID 55958082
N-naphthalen-1-yl-2-pyridin-3-ylquinoline-4-carboxamide
CID 25180097
2-pyridin-3-yl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]quinoline-4-carboxamide
CID 46668985
2-(3-butoxyphenyl)-N-pyridin-3-ylquinoline-4-carboxamide
CID 56692982

Frequently Asked Questions

What is the IUPAC name of N-[6-(dimethylamino)-3-pyridinyl]-2-pyridin-3-ylquinoline-4-carboxamide?
The IUPAC name of N-[6-(dimethylamino)-3-pyridinyl]-2-pyridin-3-ylquinoline-4-carboxamide (CID 30294376) is N-[6-(dimethylamino)-3-pyridinyl]-2-pyridin-3-ylquinoline-4-carboxamide.
What is the SMILES notation for N-[6-(dimethylamino)-3-pyridinyl]-2-pyridin-3-ylquinoline-4-carboxamide?
The canonical SMILES for N-[6-(dimethylamino)-3-pyridinyl]-2-pyridin-3-ylquinoline-4-carboxamide is CN(C)c1ccc(NC(=O)c2cc(-c3cccnc3)nc3ccccc23)cn1.
What is the InChIKey of N-[6-(dimethylamino)-3-pyridinyl]-2-pyridin-3-ylquinoline-4-carboxamide?
The InChIKey is BUZXEAOMUXDMIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N5O/c1-27(2)21-10-9-16(14-24-21)25-22(28)18-12-20(15-6-5-11-23-13-15)26-19-8-4-3-7-17(18)19/h3-14H,1-2H3,(H,25,28).
What are the key properties of N-[6-(dimethylamino)-3-pyridinyl]-2-pyridin-3-ylquinoline-4-carboxamide?
N-[6-(dimethylamino)-3-pyridinyl]-2-pyridin-3-ylquinoline-4-carboxamide has a molecular weight of 369.43 g/mol, XLogP of 4.01, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(dimethylamino)-3-pyridinyl]-2-pyridin-3-ylquinoline-4-carboxamide is sourced from PubChem (CID 30294376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).