5-(2-methylpropyl)-N-(3-morpholin-4-ylpropyl)-1,2-oxazole-3-carboxamide

C15H25N3O3 — CID 5308762

IUPAC5-(2-methylpropyl)-N-(3-morpholin-4-ylpropyl)-1,2-oxazole-3-carboxamide
SMILESCC(C)Cc1cc(C(=O)NCCCN2CCOCC2)no1
InChIInChI=1S/C15H25N3O3/c1-12(2)10-13-11-14(17-21-13)15(19)16-4-3-5-18-6-8-20-9-7-18/h11-12H,3-10H2,1-2H3,(H,16,19)
InChIKeyYVSBMLDTQWRYTJ-UHFFFAOYSA-N
MW295.38 g/mol
LogP1.33
Rot. Bonds7

About 5-(2-methylpropyl)-N-(3-morpholin-4-ylpropyl)-1,2-oxazole-3-carboxamide

5-(2-methylpropyl)-N-(3-morpholin-4-ylpropyl)-1,2-oxazole-3-carboxamide (PubChem CID 5308762) has the molecular formula C15H25N3O3 and a molecular weight of 295.38 g/mol. Its IUPAC name is 5-(2-methylpropyl)-N-(3-morpholin-4-ylpropyl)-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name5-(2-methylpropyl)-N-(3-morpholin-4-ylpropyl)-1,2-oxazole-3-carboxamide
PubChem CID5308762
Molecular FormulaC15H25N3O3
Molecular Weight295.38 g/mol
Exact Mass295.19
IUPAC Name5-(2-methylpropyl)-N-(3-morpholin-4-ylpropyl)-1,2-oxazole-3-carboxamide
SMILESCC(C)Cc1cc(C(=O)NCCCN2CCOCC2)no1
InChIInChI=1S/C15H25N3O3/c1-12(2)10-13-11-14(17-21-13)15(19)16-4-3-5-18-6-8-20-9-7-18/h11-12H,3-10H2,1-2H3,(H,16,19)
InChIKeyYVSBMLDTQWRYTJ-UHFFFAOYSA-N
XLogP1.33
TPSA67.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.38
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[3-(4-morpholinyl)propyl]-5-phenyl-3-isoxazolecarboxamide
CID 2217157
5-cyclopropyl-N-(1-methanesulfonylpiperidin-4-yl)-1,2-oxazole-3-carboxamide
CID 45808906
N-cyclohexyl-5-propyl-3-isoxazolecarboxamide
CID 5307570
N-cyclohexyl-5-cyclopropylisoxazole-3-carboxamide
CID 16188020
N-[1-(2-Chloroacetyl)piperidin-4-yl]-5-cyclopropyl-1,2-oxazole-3-carboxamide
CID 118949515
N-(Butan-2-YL)-5-(2-methylpropyl)-1,2-oxazole-3-carboxamide
CID 5307751
5-(2-methylpropyl)-N-(2-morpholin-4-ylethyl)-1,2-oxazole-3-carboxamide
CID 5307969
2-[1-(cyclohexylmethyl)-3-oxopiperazin-2-yl]-N-[(3-isopropylisoxazol-5-yl)methyl]acetamide
CID 16189217
N,N-dicyclohexyl[5-(methylethyl)isoxazol-3-yl]carboxamide
CID 17253281
N,N-dicyclohexyl-5-(2-methylpropyl)-1,2-oxazole-3-carboxamide
CID 25110485
N-cyclohexyl-5-isopropylisoxazole-3-carboxamide
CID 3243071
5-cyclopropyl-N-[1-(ethanesulfonyl)piperidin-4-yl]-1,2-oxazole-3-carboxamide
CID 34390276

Frequently Asked Questions

What is the IUPAC name of 5-(2-methylpropyl)-N-(3-morpholin-4-ylpropyl)-1,2-oxazole-3-carboxamide?
The IUPAC name of 5-(2-methylpropyl)-N-(3-morpholin-4-ylpropyl)-1,2-oxazole-3-carboxamide (CID 5308762) is 5-(2-methylpropyl)-N-(3-morpholin-4-ylpropyl)-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 5-(2-methylpropyl)-N-(3-morpholin-4-ylpropyl)-1,2-oxazole-3-carboxamide?
The canonical SMILES for 5-(2-methylpropyl)-N-(3-morpholin-4-ylpropyl)-1,2-oxazole-3-carboxamide is CC(C)Cc1cc(C(=O)NCCCN2CCOCC2)no1.
What is the InChIKey of 5-(2-methylpropyl)-N-(3-morpholin-4-ylpropyl)-1,2-oxazole-3-carboxamide?
The InChIKey is YVSBMLDTQWRYTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O3/c1-12(2)10-13-11-14(17-21-13)15(19)16-4-3-5-18-6-8-20-9-7-18/h11-12H,3-10H2,1-2H3,(H,16,19).
What are the key properties of 5-(2-methylpropyl)-N-(3-morpholin-4-ylpropyl)-1,2-oxazole-3-carboxamide?
5-(2-methylpropyl)-N-(3-morpholin-4-ylpropyl)-1,2-oxazole-3-carboxamide has a molecular weight of 295.38 g/mol, XLogP of 1.33, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methylpropyl)-N-(3-morpholin-4-ylpropyl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 5308762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).