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

C23H22N4O2 — CID 109219711

IUPACN-(3-acetamidophenyl)-4-(3,4-dihydro-2H-quinolin-1-yl)pyridine-2-carboxamide
SMILESCC(=O)Nc1cccc(NC(=O)c2cc(N3CCCc4ccccc43)ccn2)c1
InChIInChI=1S/C23H22N4O2/c1-16(28)25-18-8-4-9-19(14-18)26-23(29)21-15-20(11-12-24-21)27-13-5-7-17-6-2-3-10-22(17)27/h2-4,6,8-12,14-15H,5,7,13H2,1H3,(H,25,28)(H,26,29)
InChIKeyMSDWBOWGOZAZTF-UHFFFAOYSA-N
MW386.46 g/mol
LogP4.38
Rot. Bonds4

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

N-(3-acetamidophenyl)-4-(3,4-dihydro-2H-quinolin-1-yl)pyridine-2-carboxamide (PubChem CID 109219711) has the molecular formula C23H22N4O2 and a molecular weight of 386.46 g/mol. Its IUPAC name is N-(3-acetamidophenyl)-4-(3,4-dihydro-2H-quinolin-1-yl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(3-acetamidophenyl)-4-(3,4-dihydro-2H-quinolin-1-yl)pyridine-2-carboxamide
PubChem CID109219711
Molecular FormulaC23H22N4O2
Molecular Weight386.46 g/mol
Exact Mass386.17
IUPAC NameN-(3-acetamidophenyl)-4-(3,4-dihydro-2H-quinolin-1-yl)pyridine-2-carboxamide
SMILESCC(=O)Nc1cccc(NC(=O)c2cc(N3CCCc4ccccc43)ccn2)c1
InChIInChI=1S/C23H22N4O2/c1-16(28)25-18-8-4-9-19(14-18)26-23(29)21-15-20(11-12-24-21)27-13-5-7-17-6-2-3-10-22(17)27/h2-4,6,8-12,14-15H,5,7,13H2,1H3,(H,25,28)(H,26,29)
InChIKeyMSDWBOWGOZAZTF-UHFFFAOYSA-N
XLogP4.38
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.46
LogP ≤ 54.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(3,4-dihydro-2H-quinolin-1-yl)-N-phenylpyridine-2-carboxamide
CID 109218742
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(3,4-dihydro-2H-quinolin-1-yl)pyridine-2-carboxamide
CID 109219720
N-(3-acetamidophenyl)-5-(2,3-dihydroindol-1-yl)pyridine-2-carboxamide
CID 109197843
4-(3,4-dihydro-2H-quinolin-1-yl)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2-carboxamide
CID 109219730
N-cyclopentyl-4-(3,4-dihydro-2H-quinolin-1-yl)pyridine-2-carboxamide
CID 109204075
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-methoxyethyl)pyridine-2-carboxamide
CID 109205740
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
[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-phenylethyl)pyridine-2-carboxamide
CID 109213564
[4-(3,4-dihydro-2H-quinolin-1-yl)-2-pyridinyl]-piperidin-1-ylmethanone
CID 109204447

Frequently Asked Questions

What is the IUPAC name of N-(3-acetamidophenyl)-4-(3,4-dihydro-2H-quinolin-1-yl)pyridine-2-carboxamide?
The IUPAC name of N-(3-acetamidophenyl)-4-(3,4-dihydro-2H-quinolin-1-yl)pyridine-2-carboxamide (CID 109219711) is N-(3-acetamidophenyl)-4-(3,4-dihydro-2H-quinolin-1-yl)pyridine-2-carboxamide.
What is the SMILES notation for N-(3-acetamidophenyl)-4-(3,4-dihydro-2H-quinolin-1-yl)pyridine-2-carboxamide?
The canonical SMILES for N-(3-acetamidophenyl)-4-(3,4-dihydro-2H-quinolin-1-yl)pyridine-2-carboxamide is CC(=O)Nc1cccc(NC(=O)c2cc(N3CCCc4ccccc43)ccn2)c1.
What is the InChIKey of N-(3-acetamidophenyl)-4-(3,4-dihydro-2H-quinolin-1-yl)pyridine-2-carboxamide?
The InChIKey is MSDWBOWGOZAZTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N4O2/c1-16(28)25-18-8-4-9-19(14-18)26-23(29)21-15-20(11-12-24-21)27-13-5-7-17-6-2-3-10-22(17)27/h2-4,6,8-12,14-15H,5,7,13H2,1H3,(H,25,28)(H,26,29).
What are the key properties of N-(3-acetamidophenyl)-4-(3,4-dihydro-2H-quinolin-1-yl)pyridine-2-carboxamide?
N-(3-acetamidophenyl)-4-(3,4-dihydro-2H-quinolin-1-yl)pyridine-2-carboxamide has a molecular weight of 386.46 g/mol, XLogP of 4.38, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetamidophenyl)-4-(3,4-dihydro-2H-quinolin-1-yl)pyridine-2-carboxamide is sourced from PubChem (CID 109219711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).