1-(2-morpholin-4-ylethyl)-7-(3-phenylphenyl)-3,4-dihydroquinolin-2-one

C27H28N2O2 — CID 175346344

IUPAC1-(2-morpholin-4-ylethyl)-7-(3-phenylphenyl)-3,4-dihydroquinolin-2-one
SMILESO=C1CCc2ccc(-c3cccc(-c4ccccc4)c3)cc2N1CCN1CCOCC1
InChIInChI=1S/C27H28N2O2/c30-27-12-11-22-9-10-25(20-26(22)29(27)14-13-28-15-17-31-18-16-28)24-8-4-7-23(19-24)21-5-2-1-3-6-21/h1-10,19-20H,11-18H2
InChIKeyBKSPHTGGCOHDSK-UHFFFAOYSA-N
MW412.53 g/mol
LogP4.63
Rot. Bonds5

About 1-(2-morpholin-4-ylethyl)-7-(3-phenylphenyl)-3,4-dihydroquinolin-2-one

1-(2-morpholin-4-ylethyl)-7-(3-phenylphenyl)-3,4-dihydroquinolin-2-one (PubChem CID 175346344) has the molecular formula C27H28N2O2 and a molecular weight of 412.53 g/mol. Its IUPAC name is 1-(2-morpholin-4-ylethyl)-7-(3-phenylphenyl)-3,4-dihydroquinolin-2-one.

Molecular Properties

Compound Name1-(2-morpholin-4-ylethyl)-7-(3-phenylphenyl)-3,4-dihydroquinolin-2-one
PubChem CID175346344
Molecular FormulaC27H28N2O2
Molecular Weight412.53 g/mol
Exact Mass412.22
IUPAC Name1-(2-morpholin-4-ylethyl)-7-(3-phenylphenyl)-3,4-dihydroquinolin-2-one
SMILESO=C1CCc2ccc(-c3cccc(-c4ccccc4)c3)cc2N1CCN1CCOCC1
InChIInChI=1S/C27H28N2O2/c30-27-12-11-22-9-10-25(20-26(22)29(27)14-13-28-15-17-31-18-16-28)24-8-4-7-23(19-24)21-5-2-1-3-6-21/h1-10,19-20H,11-18H2
InChIKeyBKSPHTGGCOHDSK-UHFFFAOYSA-N
XLogP4.63
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500412.53
LogP ≤ 54.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

7-(4-fluorophenyl)-1-(2-morpholin-4-ylethyl)-3,4-dihydroquinolin-2-one
CID 175346345
7-(4-fluoro-2-methylphenyl)-1-(2-morpholin-4-ylethyl)-3,4-dihydroquinolin-2-one
CID 175346372
1-(3-hydroxypropyl)-7-morpholin-4-yl-3,4-dihydroquinolin-2-one
CID 175020264
2-(2-morpholin-4-ylethyl)-4,5-dihydro-1H-2-benzazepin-3-one
CID 162628333
7-methoxy-1-(2-piperidin-1-ylethyl)-3,4-dihydroquinolin-2-one
CID 141163160
7-(4-methylsulfonylphenyl)-1-(2-morpholin-4-ylethyl)-5H-4,1-benzoxazepin-2-one
CID 71448723
1-benzyl-6-(4-morpholin-4-ylbutoxy)-3,4-dihydroquinolin-2-one
CID 86301465
1-(2-morpholin-4-ylethyl)-5-nitro-3H-indol-2-one
CID 169265741
3-[4-(2-morpholin-4-ylethyl)phenyl]phenol
CID 70092617
2-oxo-1-(2-pyrrolidin-1-ylethyl)-3,4-dihydroquinoline-6-carboxylic acid
CID 102711309
N-(2-morpholin-4-ylethyl)-3-nitroso-3-(3-phenylphenyl)propan-1-amine
CID 168965067
5-[2-(2-amino-5-phenylphenyl)acetyl]-7-cyclopropyl-1-(2-morpholin-4-ylethyl)-3H-indol-2-one
CID 153183619

Frequently Asked Questions

What is the IUPAC name of 1-(2-morpholin-4-ylethyl)-7-(3-phenylphenyl)-3,4-dihydroquinolin-2-one?
The IUPAC name of 1-(2-morpholin-4-ylethyl)-7-(3-phenylphenyl)-3,4-dihydroquinolin-2-one (CID 175346344) is 1-(2-morpholin-4-ylethyl)-7-(3-phenylphenyl)-3,4-dihydroquinolin-2-one.
What is the SMILES notation for 1-(2-morpholin-4-ylethyl)-7-(3-phenylphenyl)-3,4-dihydroquinolin-2-one?
The canonical SMILES for 1-(2-morpholin-4-ylethyl)-7-(3-phenylphenyl)-3,4-dihydroquinolin-2-one is O=C1CCc2ccc(-c3cccc(-c4ccccc4)c3)cc2N1CCN1CCOCC1.
What is the InChIKey of 1-(2-morpholin-4-ylethyl)-7-(3-phenylphenyl)-3,4-dihydroquinolin-2-one?
The InChIKey is BKSPHTGGCOHDSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H28N2O2/c30-27-12-11-22-9-10-25(20-26(22)29(27)14-13-28-15-17-31-18-16-28)24-8-4-7-23(19-24)21-5-2-1-3-6-21/h1-10,19-20H,11-18H2.
What are the key properties of 1-(2-morpholin-4-ylethyl)-7-(3-phenylphenyl)-3,4-dihydroquinolin-2-one?
1-(2-morpholin-4-ylethyl)-7-(3-phenylphenyl)-3,4-dihydroquinolin-2-one has a molecular weight of 412.53 g/mol, XLogP of 4.63, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-morpholin-4-ylethyl)-7-(3-phenylphenyl)-3,4-dihydroquinolin-2-one is sourced from PubChem (CID 175346344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).