N-benzyl-N-(1-morpholin-4-ylpropan-2-yl)-3-phenyl-4,5-dihydro-1,2-oxazole-5-carboxamide

C24H29N3O3 — CID 56500966

IUPACN-benzyl-N-(1-morpholin-4-ylpropan-2-yl)-3-phenyl-4,5-dihydro-1,2-oxazole-5-carboxamide
SMILESCC(CN1CCOCC1)N(Cc1ccccc1)C(=O)C1CC(c2ccccc2)=NO1
InChIInChI=1S/C24H29N3O3/c1-19(17-26-12-14-29-15-13-26)27(18-20-8-4-2-5-9-20)24(28)23-16-22(25-30-23)21-10-6-3-7-11-21/h2-11,19,23H,12-18H2,1H3
InChIKeySTYVZNIFGKRISZ-UHFFFAOYSA-N
MW407.51 g/mol
LogP2.93
Rot. Bonds7

About N-benzyl-N-(1-morpholin-4-ylpropan-2-yl)-3-phenyl-4,5-dihydro-1,2-oxazole-5-carboxamide

N-benzyl-N-(1-morpholin-4-ylpropan-2-yl)-3-phenyl-4,5-dihydro-1,2-oxazole-5-carboxamide (PubChem CID 56500966) has the molecular formula C24H29N3O3 and a molecular weight of 407.51 g/mol. Its IUPAC name is N-benzyl-N-(1-morpholin-4-ylpropan-2-yl)-3-phenyl-4,5-dihydro-1,2-oxazole-5-carboxamide.

Molecular Properties

Compound NameN-benzyl-N-(1-morpholin-4-ylpropan-2-yl)-3-phenyl-4,5-dihydro-1,2-oxazole-5-carboxamide
PubChem CID56500966
Molecular FormulaC24H29N3O3
Molecular Weight407.51 g/mol
Exact Mass407.22
IUPAC NameN-benzyl-N-(1-morpholin-4-ylpropan-2-yl)-3-phenyl-4,5-dihydro-1,2-oxazole-5-carboxamide
SMILESCC(CN1CCOCC1)N(Cc1ccccc1)C(=O)C1CC(c2ccccc2)=NO1
InChIInChI=1S/C24H29N3O3/c1-19(17-26-12-14-29-15-13-26)27(18-20-8-4-2-5-9-20)24(28)23-16-22(25-30-23)21-10-6-3-7-11-21/h2-11,19,23H,12-18H2,1H3
InChIKeySTYVZNIFGKRISZ-UHFFFAOYSA-N
XLogP2.93
TPSA54.37 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500407.51
LogP ≤ 52.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze N-benzyl-N-(1-morpholin-4-ylpropan-2-yl)-3-phenyl-4,5-dihydro-1,2-oxazole-5-carboxamide with MolForge

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Related Compounds

4-N-benzyl-1-N,1-N-diethyl-4-N-(1-morpholin-4-ylpropan-2-yl)piperidine-1,4-dicarboxamide
CID 56501899
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CID 56500998
2-amino-N-benzyl-N-(1-morpholin-4-ylpropan-2-yl)pentanamide
CID 119877071
N-benzyl-N-(1-morpholin-4-ylpropan-2-yl)-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
CID 56501375
N-benzyl-N-(1-morpholin-4-ylpropan-2-yl)-2-thiophen-3-yl-1,3-thiazole-4-carboxamide
CID 56501664
N-benzyl-4-(methylamino)-N-(1-morpholin-4-ylpropan-2-yl)butanamide
CID 119877069
2-(4-aminophenyl)-N-benzyl-N-(1-morpholin-4-ylpropan-2-yl)acetamide;dihydrochloride
CID 119877064
N-benzyl-3-chloro-N-(1-morpholin-4-ylpropan-2-yl)benzamide
CID 56501396
N-benzyl-2-(4-ethoxyphenyl)-N-(1-morpholin-4-ylpropan-2-yl)acetamide
CID 56500857
N-benzyl-2-[(2-chlorophenyl)methoxy]-N-(1-morpholin-4-ylpropan-2-yl)acetamide
CID 56501629
methyl 3-[benzyl-(3-phenyl-4,5-dihydro-1,2-oxazole-5-carbonyl)amino]propanoate
CID 55668286
N-benzyl-4-(methylsulfonylmethyl)-N-(1-morpholin-4-ylpropan-2-yl)benzamide
CID 56500850

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-(1-morpholin-4-ylpropan-2-yl)-3-phenyl-4,5-dihydro-1,2-oxazole-5-carboxamide?
The IUPAC name of N-benzyl-N-(1-morpholin-4-ylpropan-2-yl)-3-phenyl-4,5-dihydro-1,2-oxazole-5-carboxamide (CID 56500966) is N-benzyl-N-(1-morpholin-4-ylpropan-2-yl)-3-phenyl-4,5-dihydro-1,2-oxazole-5-carboxamide.
What is the SMILES notation for N-benzyl-N-(1-morpholin-4-ylpropan-2-yl)-3-phenyl-4,5-dihydro-1,2-oxazole-5-carboxamide?
The canonical SMILES for N-benzyl-N-(1-morpholin-4-ylpropan-2-yl)-3-phenyl-4,5-dihydro-1,2-oxazole-5-carboxamide is CC(CN1CCOCC1)N(Cc1ccccc1)C(=O)C1CC(c2ccccc2)=NO1.
What is the InChIKey of N-benzyl-N-(1-morpholin-4-ylpropan-2-yl)-3-phenyl-4,5-dihydro-1,2-oxazole-5-carboxamide?
The InChIKey is STYVZNIFGKRISZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H29N3O3/c1-19(17-26-12-14-29-15-13-26)27(18-20-8-4-2-5-9-20)24(28)23-16-22(25-30-23)21-10-6-3-7-11-21/h2-11,19,23H,12-18H2,1H3.
What are the key properties of N-benzyl-N-(1-morpholin-4-ylpropan-2-yl)-3-phenyl-4,5-dihydro-1,2-oxazole-5-carboxamide?
N-benzyl-N-(1-morpholin-4-ylpropan-2-yl)-3-phenyl-4,5-dihydro-1,2-oxazole-5-carboxamide has a molecular weight of 407.51 g/mol, XLogP of 2.93, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-(1-morpholin-4-ylpropan-2-yl)-3-phenyl-4,5-dihydro-1,2-oxazole-5-carboxamide is sourced from PubChem (CID 56500966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).