3-(3,4-dihydro-2H-quinolin-1-yl)-N-(4-phenoxyphenyl)propanamide

C24H24N2O2 — CID 109035049

IUPAC3-(3,4-dihydro-2H-quinolin-1-yl)-N-(4-phenoxyphenyl)propanamide
SMILESO=C(CCN1CCCc2ccccc21)Nc1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C24H24N2O2/c27-24(16-18-26-17-6-8-19-7-4-5-11-23(19)26)25-20-12-14-22(15-13-20)28-21-9-2-1-3-10-21/h1-5,7,9-15H,6,8,16-18H2,(H,25,27)
InChIKeyRMMXOEDTZIEHSE-UHFFFAOYSA-N
MW372.47 g/mol
LogP5.26
Rot. Bonds6

About 3-(3,4-dihydro-2H-quinolin-1-yl)-N-(4-phenoxyphenyl)propanamide

3-(3,4-dihydro-2H-quinolin-1-yl)-N-(4-phenoxyphenyl)propanamide (PubChem CID 109035049) has the molecular formula C24H24N2O2 and a molecular weight of 372.47 g/mol. Its IUPAC name is 3-(3,4-dihydro-2H-quinolin-1-yl)-N-(4-phenoxyphenyl)propanamide.

Molecular Properties

Compound Name3-(3,4-dihydro-2H-quinolin-1-yl)-N-(4-phenoxyphenyl)propanamide
PubChem CID109035049
Molecular FormulaC24H24N2O2
Molecular Weight372.47 g/mol
Exact Mass372.18
IUPAC Name3-(3,4-dihydro-2H-quinolin-1-yl)-N-(4-phenoxyphenyl)propanamide
SMILESO=C(CCN1CCCc2ccccc21)Nc1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C24H24N2O2/c27-24(16-18-26-17-6-8-19-7-4-5-11-23(19)26)25-20-12-14-22(15-13-20)28-21-9-2-1-3-10-21/h1-5,7,9-15H,6,8,16-18H2,(H,25,27)
InChIKeyRMMXOEDTZIEHSE-UHFFFAOYSA-N
XLogP5.26
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.47
LogP ≤ 55.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(4-phenoxyphenyl)propanamide
CID 109024615
2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxo-N-(4-phenoxyphenyl)acetamide
CID 108505566
N-[4-[2-(3,4-dihydro-2H-quinolin-1-yl)ethoxy]phenyl]acetamide
CID 71912035
4-[[2-(3,4-dihydro-2H-quinolin-1-yl)acetyl]amino]benzoic acid
CID 28866702
3-(3,4-dihydro-2H-quinolin-1-yl)-N-(2-fluorophenyl)propanamide
CID 24588519
3-(3,4-dihydro-2H-quinolin-1-yl)-N-(2,3,4-trifluorophenyl)propanamide
CID 109035071
3-(3,4-dihydro-2H-quinolin-1-yl)-N-(1-phenylethyl)propanamide
CID 24588515
3-(3,4-dihydro-2H-quinolin-1-yl)-N-(2-morpholin-4-ylphenyl)propanamide
CID 109035047
N-(3-chloro-4-methylphenyl)-3-(2,3-dihydroindol-1-yl)propanamide
CID 109034837
2-(3,4-dihydro-2H-quinolin-1-yl)-N-(4-methylsulfanylphenyl)acetamide
CID 46657943
N-[4-[[2-(3,4-dihydro-2H-quinolin-1-yl)acetyl]amino]phenyl]-2-methylpropanamide
CID 54817003
3-(3-methylpiperidin-1-yl)-N-(4-phenoxyphenyl)propanamide
CID 109032975

Frequently Asked Questions

What is the IUPAC name of 3-(3,4-dihydro-2H-quinolin-1-yl)-N-(4-phenoxyphenyl)propanamide?
The IUPAC name of 3-(3,4-dihydro-2H-quinolin-1-yl)-N-(4-phenoxyphenyl)propanamide (CID 109035049) is 3-(3,4-dihydro-2H-quinolin-1-yl)-N-(4-phenoxyphenyl)propanamide.
What is the SMILES notation for 3-(3,4-dihydro-2H-quinolin-1-yl)-N-(4-phenoxyphenyl)propanamide?
The canonical SMILES for 3-(3,4-dihydro-2H-quinolin-1-yl)-N-(4-phenoxyphenyl)propanamide is O=C(CCN1CCCc2ccccc21)Nc1ccc(Oc2ccccc2)cc1.
What is the InChIKey of 3-(3,4-dihydro-2H-quinolin-1-yl)-N-(4-phenoxyphenyl)propanamide?
The InChIKey is RMMXOEDTZIEHSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O2/c27-24(16-18-26-17-6-8-19-7-4-5-11-23(19)26)25-20-12-14-22(15-13-20)28-21-9-2-1-3-10-21/h1-5,7,9-15H,6,8,16-18H2,(H,25,27).
What are the key properties of 3-(3,4-dihydro-2H-quinolin-1-yl)-N-(4-phenoxyphenyl)propanamide?
3-(3,4-dihydro-2H-quinolin-1-yl)-N-(4-phenoxyphenyl)propanamide has a molecular weight of 372.47 g/mol, XLogP of 5.26, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,4-dihydro-2H-quinolin-1-yl)-N-(4-phenoxyphenyl)propanamide is sourced from PubChem (CID 109035049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).