[1-(4-hydroxybenzoyl)-3,4-dihydro-2H-quinolin-4-yl]-morpholin-4-ylmethanone

C21H22N2O4 — CID 143284740

IUPAC[1-(4-hydroxybenzoyl)-3,4-dihydro-2H-quinolin-4-yl]-morpholin-4-ylmethanone
SMILESO=C(C1CCN(C(=O)c2ccc(O)cc2)c2ccccc21)N1CCOCC1
InChIInChI=1S/C21H22N2O4/c24-16-7-5-15(6-8-16)20(25)23-10-9-18(17-3-1-2-4-19(17)23)21(26)22-11-13-27-14-12-22/h1-8,18,24H,9-14H2
InChIKeyMKPWBKDCHXGHGV-UHFFFAOYSA-N
MW366.42 g/mol
LogP2.39
Rot. Bonds2

About [1-(4-hydroxybenzoyl)-3,4-dihydro-2H-quinolin-4-yl]-morpholin-4-ylmethanone

[1-(4-hydroxybenzoyl)-3,4-dihydro-2H-quinolin-4-yl]-morpholin-4-ylmethanone (PubChem CID 143284740) has the molecular formula C21H22N2O4 and a molecular weight of 366.42 g/mol. Its IUPAC name is [1-(4-hydroxybenzoyl)-3,4-dihydro-2H-quinolin-4-yl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[1-(4-hydroxybenzoyl)-3,4-dihydro-2H-quinolin-4-yl]-morpholin-4-ylmethanone
PubChem CID143284740
Molecular FormulaC21H22N2O4
Molecular Weight366.42 g/mol
Exact Mass366.16
IUPAC Name[1-(4-hydroxybenzoyl)-3,4-dihydro-2H-quinolin-4-yl]-morpholin-4-ylmethanone
SMILESO=C(C1CCN(C(=O)c2ccc(O)cc2)c2ccccc21)N1CCOCC1
InChIInChI=1S/C21H22N2O4/c24-16-7-5-15(6-8-16)20(25)23-10-9-18(17-3-1-2-4-19(17)23)21(26)22-11-13-27-14-12-22/h1-8,18,24H,9-14H2
InChIKeyMKPWBKDCHXGHGV-UHFFFAOYSA-N
XLogP2.39
TPSA70.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.42
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[4-(4-hydroxybenzoyl)piperazin-1-yl]-(oxan-4-yl)methanone
CID 36914707
(4-aminophenyl)-(4-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone
CID 19607756
[4-(4-fluorobenzoyl)-2,3-dihydro-1,4-benzoxazin-2-yl]-morpholin-4-ylmethanone
CID 17464763
[(2R)-4-(4-methylbenzoyl)-2,3-dihydro-1,4-benzoxazin-2-yl]-morpholin-4-ylmethanone
CID 9246660
1-(5-methylfuran-3-carbonyl)-3,4-dihydro-2H-quinoline-4-carboxylic acid
CID 114819137
(1-benzoyl-2,3-dihydroindol-2-yl)-morpholin-4-ylmethanone
CID 20954563
(5-hydroxy-2,3,4,5-tetrahydro-1-benzazepin-1-yl)-morpholin-4-ylmethanone
CID 114337465
morpholin-4-yl-[(2R)-4-[4-(trifluoromethyl)benzoyl]-2,3-dihydro-1,4-benzoxazin-2-yl]methanone
CID 27446701
[3-(diethylamino)pyrazol-1-yl]-[(4S)-1-(4-methoxybenzoyl)-3,4-dihydro-2H-quinolin-4-yl]methanone
CID 143284820
(4-methyl-3,4-dihydro-2H-quinolin-1-yl)-(oxolan-3-yl)methanone
CID 75921285
(4-fluorophenyl)-(4-methoxy-3,4-dihydro-2H-quinolin-1-yl)methanone
CID 110709472
(4-methoxy-3,4-dihydro-2H-quinolin-1-yl)-(4-methoxyphenyl)methanone
CID 110709476

Frequently Asked Questions

What is the IUPAC name of [1-(4-hydroxybenzoyl)-3,4-dihydro-2H-quinolin-4-yl]-morpholin-4-ylmethanone?
The IUPAC name of [1-(4-hydroxybenzoyl)-3,4-dihydro-2H-quinolin-4-yl]-morpholin-4-ylmethanone (CID 143284740) is [1-(4-hydroxybenzoyl)-3,4-dihydro-2H-quinolin-4-yl]-morpholin-4-ylmethanone.
What is the SMILES notation for [1-(4-hydroxybenzoyl)-3,4-dihydro-2H-quinolin-4-yl]-morpholin-4-ylmethanone?
The canonical SMILES for [1-(4-hydroxybenzoyl)-3,4-dihydro-2H-quinolin-4-yl]-morpholin-4-ylmethanone is O=C(C1CCN(C(=O)c2ccc(O)cc2)c2ccccc21)N1CCOCC1.
What is the InChIKey of [1-(4-hydroxybenzoyl)-3,4-dihydro-2H-quinolin-4-yl]-morpholin-4-ylmethanone?
The InChIKey is MKPWBKDCHXGHGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22N2O4/c24-16-7-5-15(6-8-16)20(25)23-10-9-18(17-3-1-2-4-19(17)23)21(26)22-11-13-27-14-12-22/h1-8,18,24H,9-14H2.
What are the key properties of [1-(4-hydroxybenzoyl)-3,4-dihydro-2H-quinolin-4-yl]-morpholin-4-ylmethanone?
[1-(4-hydroxybenzoyl)-3,4-dihydro-2H-quinolin-4-yl]-morpholin-4-ylmethanone has a molecular weight of 366.42 g/mol, XLogP of 2.39, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-hydroxybenzoyl)-3,4-dihydro-2H-quinolin-4-yl]-morpholin-4-ylmethanone is sourced from PubChem (CID 143284740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).