2-morpholin-4-yl-4-oxo-N-phenyl-4-(5,6,7,8-tetrahydronaphthalen-1-yl)butanamide

C24H28N2O3 — CID 90677194

IUPAC2-morpholin-4-yl-4-oxo-N-phenyl-4-(5,6,7,8-tetrahydronaphthalen-1-yl)butanamide
SMILESO=C(CC(C(=O)Nc1ccccc1)N1CCOCC1)c1cccc2c1CCCC2
InChIInChI=1S/C24H28N2O3/c27-23(21-12-6-8-18-7-4-5-11-20(18)21)17-22(26-13-15-29-16-14-26)24(28)25-19-9-2-1-3-10-19/h1-3,6,8-10,12,22H,4-5,7,11,13-17H2,(H,25,28)
InChIKeyKHGZDSVIHSIFGL-UHFFFAOYSA-N
MW392.50 g/mol
LogP3.48
Rot. Bonds6

About 2-morpholin-4-yl-4-oxo-N-phenyl-4-(5,6,7,8-tetrahydronaphthalen-1-yl)butanamide

2-morpholin-4-yl-4-oxo-N-phenyl-4-(5,6,7,8-tetrahydronaphthalen-1-yl)butanamide (PubChem CID 90677194) has the molecular formula C24H28N2O3 and a molecular weight of 392.50 g/mol. Its IUPAC name is 2-morpholin-4-yl-4-oxo-N-phenyl-4-(5,6,7,8-tetrahydronaphthalen-1-yl)butanamide.

Molecular Properties

Compound Name2-morpholin-4-yl-4-oxo-N-phenyl-4-(5,6,7,8-tetrahydronaphthalen-1-yl)butanamide
PubChem CID90677194
Molecular FormulaC24H28N2O3
Molecular Weight392.50 g/mol
Exact Mass392.21
IUPAC Name2-morpholin-4-yl-4-oxo-N-phenyl-4-(5,6,7,8-tetrahydronaphthalen-1-yl)butanamide
SMILESO=C(CC(C(=O)Nc1ccccc1)N1CCOCC1)c1cccc2c1CCCC2
InChIInChI=1S/C24H28N2O3/c27-23(21-12-6-8-18-7-4-5-11-20(18)21)17-22(26-13-15-29-16-14-26)24(28)25-19-9-2-1-3-10-19/h1-3,6,8-10,12,22H,4-5,7,11,13-17H2,(H,25,28)
InChIKeyKHGZDSVIHSIFGL-UHFFFAOYSA-N
XLogP3.48
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.50
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-morpholin-4-yl-4-(naphthalen-2-ylamino)-4-oxobutanoic acid
CID 5000095
1-(5,6,7,8-tetrahydronaphthalen-1-yl)propan-1-one
CID 14994244
N-(4-morpholin-4-ylsulfonylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)propanamide
CID 133251824
2-(2-morpholin-4-yl-2-phenylethyl)-1-(5,6,7,8-tetrahydronaphthalen-1-yl)guanidine
CID 111721147
cyclobutane;4-(3-diphenylphosphanylcarbonyl-2,4,6-trimethylphenyl)-N-methyl-2-morpholin-4-yl-4-oxobutanamide
CID 171830519
2-methyl-N-[3-methyl-1-[4-(morpholin-4-ylmethyl)anilino]-1-oxobutan-2-yl]benzamide
CID 78802635
(2R)-N-(3-acetylphenyl)-2-morpholin-4-ylpropanamide
CID 8903956
CID 131887032
CID 131887032
2-[4-(2,3-dihydro-1H-indene-4-carbonylamino)oxan-4-yl]acetic acid
CID 120686745
(2R)-2-morpholin-4-yl-1,3-diphenylpropan-1-one
CID 7000195
(2R)-3-(3,4-dihydro-2H-quinolin-1-yl)-2-iodo-N-phenylpropanamide
CID 126537248
4-(4-chloroanilino)-4-oxo-3-piperidin-1-ylbutanoic acid
CID 2957775

Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-yl-4-oxo-N-phenyl-4-(5,6,7,8-tetrahydronaphthalen-1-yl)butanamide?
The IUPAC name of 2-morpholin-4-yl-4-oxo-N-phenyl-4-(5,6,7,8-tetrahydronaphthalen-1-yl)butanamide (CID 90677194) is 2-morpholin-4-yl-4-oxo-N-phenyl-4-(5,6,7,8-tetrahydronaphthalen-1-yl)butanamide.
What is the SMILES notation for 2-morpholin-4-yl-4-oxo-N-phenyl-4-(5,6,7,8-tetrahydronaphthalen-1-yl)butanamide?
The canonical SMILES for 2-morpholin-4-yl-4-oxo-N-phenyl-4-(5,6,7,8-tetrahydronaphthalen-1-yl)butanamide is O=C(CC(C(=O)Nc1ccccc1)N1CCOCC1)c1cccc2c1CCCC2.
What is the InChIKey of 2-morpholin-4-yl-4-oxo-N-phenyl-4-(5,6,7,8-tetrahydronaphthalen-1-yl)butanamide?
The InChIKey is KHGZDSVIHSIFGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N2O3/c27-23(21-12-6-8-18-7-4-5-11-20(18)21)17-22(26-13-15-29-16-14-26)24(28)25-19-9-2-1-3-10-19/h1-3,6,8-10,12,22H,4-5,7,11,13-17H2,(H,25,28).
What are the key properties of 2-morpholin-4-yl-4-oxo-N-phenyl-4-(5,6,7,8-tetrahydronaphthalen-1-yl)butanamide?
2-morpholin-4-yl-4-oxo-N-phenyl-4-(5,6,7,8-tetrahydronaphthalen-1-yl)butanamide has a molecular weight of 392.50 g/mol, XLogP of 3.48, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-yl-4-oxo-N-phenyl-4-(5,6,7,8-tetrahydronaphthalen-1-yl)butanamide is sourced from PubChem (CID 90677194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).