3-anilino-1-morpholin-4-yl-3-phenylpropan-1-one

C19H22N2O2 — CID 13116197

IUPAC3-anilino-1-morpholin-4-yl-3-phenylpropan-1-one
SMILESO=C(CC(Nc1ccccc1)c1ccccc1)N1CCOCC1
InChIInChI=1S/C19H22N2O2/c22-19(21-11-13-23-14-12-21)15-18(16-7-3-1-4-8-16)20-17-9-5-2-6-10-17/h1-10,18,20H,11-15H2
InChIKeySVGLMBXYNXFGBZ-UHFFFAOYSA-N
MW310.40 g/mol
LogP3.09
Rot. Bonds5

About 3-anilino-1-morpholin-4-yl-3-phenylpropan-1-one

3-anilino-1-morpholin-4-yl-3-phenylpropan-1-one (PubChem CID 13116197) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is 3-anilino-1-morpholin-4-yl-3-phenylpropan-1-one.

Molecular Properties

Compound Name3-anilino-1-morpholin-4-yl-3-phenylpropan-1-one
PubChem CID13116197
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC Name3-anilino-1-morpholin-4-yl-3-phenylpropan-1-one
SMILESO=C(CC(Nc1ccccc1)c1ccccc1)N1CCOCC1
InChIInChI=1S/C19H22N2O2/c22-19(21-11-13-23-14-12-21)15-18(16-7-3-1-4-8-16)20-17-9-5-2-6-10-17/h1-10,18,20H,11-15H2
InChIKeySVGLMBXYNXFGBZ-UHFFFAOYSA-N
XLogP3.09
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-morpholin-4-yl-4-oxo-2-phenylbutanoic acid
CID 82133442
(3R)-3-(4-chlorophenyl)-1-morpholin-4-yl-3-phenylpropan-1-one
CID 26317426
(3R)-3-(furan-2-yl)-1-morpholin-4-yl-3-phenylpropan-1-one
CID 948351
N-(2-morpholin-4-yl-2-oxoethyl)-2,2-diphenylacetamide
CID 110712346
3-(1,3-benzodioxol-5-yl)-1-morpholin-4-yl-3-phenylpropan-1-one
CID 45197792
2-benzhydrylsulfanyl-1-morpholin-4-ylethanone
CID 4089685
(2-morpholin-4-yl-2-oxoethyl) (3S)-3-benzamido-3-phenylpropanoate
CID 7221898
(3S)-3-(5-bromo-2-hydroxyphenyl)-1-morpholin-4-yl-3-phenylpropan-1-one
CID 1331148
(3S)-3-(2-hydroxy-5-methylphenyl)-1-morpholin-4-yl-3-phenylpropan-1-one
CID 40595933
4-morpholin-4-yl-4-oxo-N-phenylbutanamide
CID 9341047
(3S)-3-(2-hydroxy-4-methylphenyl)-1-morpholin-4-yl-3-phenylpropan-1-one
CID 740584
2-(benzylamino)-1-morpholin-4-ylethanone
CID 23252432

Frequently Asked Questions

What is the IUPAC name of 3-anilino-1-morpholin-4-yl-3-phenylpropan-1-one?
The IUPAC name of 3-anilino-1-morpholin-4-yl-3-phenylpropan-1-one (CID 13116197) is 3-anilino-1-morpholin-4-yl-3-phenylpropan-1-one.
What is the SMILES notation for 3-anilino-1-morpholin-4-yl-3-phenylpropan-1-one?
The canonical SMILES for 3-anilino-1-morpholin-4-yl-3-phenylpropan-1-one is O=C(CC(Nc1ccccc1)c1ccccc1)N1CCOCC1.
What is the InChIKey of 3-anilino-1-morpholin-4-yl-3-phenylpropan-1-one?
The InChIKey is SVGLMBXYNXFGBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2/c22-19(21-11-13-23-14-12-21)15-18(16-7-3-1-4-8-16)20-17-9-5-2-6-10-17/h1-10,18,20H,11-15H2.
What are the key properties of 3-anilino-1-morpholin-4-yl-3-phenylpropan-1-one?
3-anilino-1-morpholin-4-yl-3-phenylpropan-1-one has a molecular weight of 310.40 g/mol, XLogP of 3.09, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-anilino-1-morpholin-4-yl-3-phenylpropan-1-one is sourced from PubChem (CID 13116197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).