2-pyridin-2-yl-N-(1-pyridin-3-ylethyl)quinoline-4-carboxamide

C22H18N4O — CID 24619819

IUPAC2-pyridin-2-yl-N-(1-pyridin-3-ylethyl)quinoline-4-carboxamide
SMILESCC(NC(=O)c1cc(-c2ccccn2)nc2ccccc12)c1cccnc1
InChIInChI=1S/C22H18N4O/c1-15(16-7-6-11-23-14-16)25-22(27)18-13-21(20-10-4-5-12-24-20)26-19-9-3-2-8-17(18)19/h2-15H,1H3,(H,25,27)
InChIKeyAEUCSNHNKKYPIX-UHFFFAOYSA-N
MW354.41 g/mol
LogP4.18
Rot. Bonds4

About 2-pyridin-2-yl-N-(1-pyridin-3-ylethyl)quinoline-4-carboxamide

2-pyridin-2-yl-N-(1-pyridin-3-ylethyl)quinoline-4-carboxamide (PubChem CID 24619819) has the molecular formula C22H18N4O and a molecular weight of 354.41 g/mol. Its IUPAC name is 2-pyridin-2-yl-N-(1-pyridin-3-ylethyl)quinoline-4-carboxamide.

Molecular Properties

Compound Name2-pyridin-2-yl-N-(1-pyridin-3-ylethyl)quinoline-4-carboxamide
PubChem CID24619819
Molecular FormulaC22H18N4O
Molecular Weight354.41 g/mol
Exact Mass354.15
IUPAC Name2-pyridin-2-yl-N-(1-pyridin-3-ylethyl)quinoline-4-carboxamide
SMILESCC(NC(=O)c1cc(-c2ccccn2)nc2ccccc12)c1cccnc1
InChIInChI=1S/C22H18N4O/c1-15(16-7-6-11-23-14-16)25-22(27)18-13-21(20-10-4-5-12-24-20)26-19-9-3-2-8-17(18)19/h2-15H,1H3,(H,25,27)
InChIKeyAEUCSNHNKKYPIX-UHFFFAOYSA-N
XLogP4.18
TPSA67.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.41
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-cyclopropyl-N-(1-pyridin-3-ylethyl)quinoline-4-carboxamide
CID 17406063
N-ethyl-2-pyridin-2-ylquinoline-4-carboxamide
CID 17473754
N'-(4-methylpentanoyl)-2-pyridin-2-ylquinoline-4-carbohydrazide
CID 26775333
2-hydroxy-N-(1-pyridin-3-ylethyl)benzamide
CID 43419974
2-(furan-2-yl)-N-[(1R)-1-phenylethyl]quinoline-4-carboxamide
CID 903434
N-(5-methyl-1H-pyrazol-3-yl)-2-pyridin-2-ylquinoline-4-carboxamide
CID 4793520
N-[(2S)-3,3-dimethylbutan-2-yl]-6-methyl-2-pyridin-2-ylquinoline-4-carboxamide
CID 899137
2-(4-fluorophenyl)-N-(1-pyridin-4-ylethyl)quinoline-4-carboxamide
CID 112761308
3-methoxy-N-(1-pyridin-3-ylethyl)naphthalene-2-carboxamide
CID 18110339
2-(5-methylfuran-2-yl)-N-[(1S)-1-phenylethyl]quinoline-4-carboxamide
CID 1221741
N-[1-[3-methoxy-4-(pyridin-4-ylmethoxy)phenyl]ethyl]-2-pyridin-3-ylquinoline-4-carboxamide
CID 55819706
N-cyclopropyl-2-pyridin-2-ylquinoline-4-carboxamide
CID 757672

Frequently Asked Questions

What is the IUPAC name of 2-pyridin-2-yl-N-(1-pyridin-3-ylethyl)quinoline-4-carboxamide?
The IUPAC name of 2-pyridin-2-yl-N-(1-pyridin-3-ylethyl)quinoline-4-carboxamide (CID 24619819) is 2-pyridin-2-yl-N-(1-pyridin-3-ylethyl)quinoline-4-carboxamide.
What is the SMILES notation for 2-pyridin-2-yl-N-(1-pyridin-3-ylethyl)quinoline-4-carboxamide?
The canonical SMILES for 2-pyridin-2-yl-N-(1-pyridin-3-ylethyl)quinoline-4-carboxamide is CC(NC(=O)c1cc(-c2ccccn2)nc2ccccc12)c1cccnc1.
What is the InChIKey of 2-pyridin-2-yl-N-(1-pyridin-3-ylethyl)quinoline-4-carboxamide?
The InChIKey is AEUCSNHNKKYPIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N4O/c1-15(16-7-6-11-23-14-16)25-22(27)18-13-21(20-10-4-5-12-24-20)26-19-9-3-2-8-17(18)19/h2-15H,1H3,(H,25,27).
What are the key properties of 2-pyridin-2-yl-N-(1-pyridin-3-ylethyl)quinoline-4-carboxamide?
2-pyridin-2-yl-N-(1-pyridin-3-ylethyl)quinoline-4-carboxamide has a molecular weight of 354.41 g/mol, XLogP of 4.18, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyridin-2-yl-N-(1-pyridin-3-ylethyl)quinoline-4-carboxamide is sourced from PubChem (CID 24619819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).