4-(3,4-dihydro-2H-quinolin-1-yl)-N-phenylpyridine-2-carboxamide

C21H19N3O — CID 109218742

IUPAC4-(3,4-dihydro-2H-quinolin-1-yl)-N-phenylpyridine-2-carboxamide
SMILESO=C(Nc1ccccc1)c1cc(N2CCCc3ccccc32)ccn1
InChIInChI=1S/C21H19N3O/c25-21(23-17-9-2-1-3-10-17)19-15-18(12-13-22-19)24-14-6-8-16-7-4-5-11-20(16)24/h1-5,7,9-13,15H,6,8,14H2,(H,23,25)
InChIKeyDOEDFKLMQDQFMR-UHFFFAOYSA-N
MW329.40 g/mol
LogP4.42
Rot. Bonds3

About 4-(3,4-dihydro-2H-quinolin-1-yl)-N-phenylpyridine-2-carboxamide

4-(3,4-dihydro-2H-quinolin-1-yl)-N-phenylpyridine-2-carboxamide (PubChem CID 109218742) has the molecular formula C21H19N3O and a molecular weight of 329.40 g/mol. Its IUPAC name is 4-(3,4-dihydro-2H-quinolin-1-yl)-N-phenylpyridine-2-carboxamide.

Molecular Properties

Compound Name4-(3,4-dihydro-2H-quinolin-1-yl)-N-phenylpyridine-2-carboxamide
PubChem CID109218742
Molecular FormulaC21H19N3O
Molecular Weight329.40 g/mol
Exact Mass329.15
IUPAC Name4-(3,4-dihydro-2H-quinolin-1-yl)-N-phenylpyridine-2-carboxamide
SMILESO=C(Nc1ccccc1)c1cc(N2CCCc3ccccc32)ccn1
InChIInChI=1S/C21H19N3O/c25-21(23-17-9-2-1-3-10-17)19-15-18(12-13-22-19)24-14-6-8-16-7-4-5-11-20(16)24/h1-5,7,9-13,15H,6,8,14H2,(H,23,25)
InChIKeyDOEDFKLMQDQFMR-UHFFFAOYSA-N
XLogP4.42
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.40
LogP ≤ 54.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-acetamidophenyl)-4-(3,4-dihydro-2H-quinolin-1-yl)pyridine-2-carboxamide
CID 109219711
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(3,4-dihydro-2H-quinolin-1-yl)pyridine-2-carboxamide
CID 109219720
N-cyclopentyl-4-(3,4-dihydro-2H-quinolin-1-yl)pyridine-2-carboxamide
CID 109204075
4-(3,4-dihydro-2H-quinolin-1-yl)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2-carboxamide
CID 109219730
4-(2,3-dihydroindol-1-yl)-N-[4-(dimethylamino)phenyl]pyridine-2-carboxamide
CID 109219625
4-(3,4-dihydro-2H-quinolin-1-yl)-N-(2-phenylethyl)pyridine-2-carboxamide
CID 109213564
[4-(3,4-dihydro-2H-quinolin-1-yl)-2-pyridinyl]-pyrrolidin-1-ylmethanone
CID 109203703
4-(3,4-dihydro-2H-quinolin-1-yl)-N-(2-methoxyethyl)pyridine-2-carboxamide
CID 109205740
[4-(3,4-dihydro-2H-quinolin-1-yl)-2-pyridinyl]-piperidin-1-ylmethanone
CID 109204447
N-(1,3-benzodioxol-5-yl)-4-(2,3-dihydroindol-1-yl)pyridine-2-carboxamide
CID 109219632
N-(3-chloro-4-methoxyphenyl)-4-(2,3-dihydroindol-1-yl)pyridine-2-carboxamide
CID 109219601
6-(3,4-dihydro-2H-quinolin-1-yl)-N-(4-methylphenyl)pyrimidine-4-carboxamide
CID 109356271

Frequently Asked Questions

What is the IUPAC name of 4-(3,4-dihydro-2H-quinolin-1-yl)-N-phenylpyridine-2-carboxamide?
The IUPAC name of 4-(3,4-dihydro-2H-quinolin-1-yl)-N-phenylpyridine-2-carboxamide (CID 109218742) is 4-(3,4-dihydro-2H-quinolin-1-yl)-N-phenylpyridine-2-carboxamide.
What is the SMILES notation for 4-(3,4-dihydro-2H-quinolin-1-yl)-N-phenylpyridine-2-carboxamide?
The canonical SMILES for 4-(3,4-dihydro-2H-quinolin-1-yl)-N-phenylpyridine-2-carboxamide is O=C(Nc1ccccc1)c1cc(N2CCCc3ccccc32)ccn1.
What is the InChIKey of 4-(3,4-dihydro-2H-quinolin-1-yl)-N-phenylpyridine-2-carboxamide?
The InChIKey is DOEDFKLMQDQFMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N3O/c25-21(23-17-9-2-1-3-10-17)19-15-18(12-13-22-19)24-14-6-8-16-7-4-5-11-20(16)24/h1-5,7,9-13,15H,6,8,14H2,(H,23,25).
What are the key properties of 4-(3,4-dihydro-2H-quinolin-1-yl)-N-phenylpyridine-2-carboxamide?
4-(3,4-dihydro-2H-quinolin-1-yl)-N-phenylpyridine-2-carboxamide has a molecular weight of 329.40 g/mol, XLogP of 4.42, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,4-dihydro-2H-quinolin-1-yl)-N-phenylpyridine-2-carboxamide is sourced from PubChem (CID 109218742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).