3-cyclohexyl-N-[3-(dimethylamino)-3-oxopropyl]-1,2-oxazole-5-carboxamide

C15H23N3O3 — CID 162666195

IUPAC3-cyclohexyl-N-[3-(dimethylamino)-3-oxopropyl]-1,2-oxazole-5-carboxamide
SMILESCN(C)C(=O)CCNC(=O)c1cc(C2CCCCC2)no1
InChIInChI=1S/C15H23N3O3/c1-18(2)14(19)8-9-16-15(20)13-10-12(17-21-13)11-6-4-3-5-7-11/h10-11H,3-9H2,1-2H3,(H,16,20)
InChIKeyKERAGXXEMSVVGF-UHFFFAOYSA-N
MW293.37 g/mol
LogP1.93
Rot. Bonds5

About 3-cyclohexyl-N-[3-(dimethylamino)-3-oxopropyl]-1,2-oxazole-5-carboxamide

3-cyclohexyl-N-[3-(dimethylamino)-3-oxopropyl]-1,2-oxazole-5-carboxamide (PubChem CID 162666195) has the molecular formula C15H23N3O3 and a molecular weight of 293.37 g/mol. Its IUPAC name is 3-cyclohexyl-N-[3-(dimethylamino)-3-oxopropyl]-1,2-oxazole-5-carboxamide.

Molecular Properties

Compound Name3-cyclohexyl-N-[3-(dimethylamino)-3-oxopropyl]-1,2-oxazole-5-carboxamide
PubChem CID162666195
Molecular FormulaC15H23N3O3
Molecular Weight293.37 g/mol
Exact Mass293.17
IUPAC Name3-cyclohexyl-N-[3-(dimethylamino)-3-oxopropyl]-1,2-oxazole-5-carboxamide
SMILESCN(C)C(=O)CCNC(=O)c1cc(C2CCCCC2)no1
InChIInChI=1S/C15H23N3O3/c1-18(2)14(19)8-9-16-15(20)13-10-12(17-21-13)11-6-4-3-5-7-11/h10-11H,3-9H2,1-2H3,(H,16,20)
InChIKeyKERAGXXEMSVVGF-UHFFFAOYSA-N
XLogP1.93
TPSA75.44 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]propanamide
CID 1484369
N-cyclohexyl-5-propyl-3-isoxazolecarboxamide
CID 5307570
N-cyclohexyl-5-cyclopropylisoxazole-3-carboxamide
CID 16188020
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
5-(2-methylpropyl)-N-(3-morpholin-4-ylpropyl)-1,2-oxazole-3-carboxamide
CID 5308762
3-Methyl-N-propylisoxazole-5-carboxamide
CID 9551512
2-[1-(cyclohexylmethyl)-3-oxopiperazin-2-yl]-N-[(3-isopropylisoxazol-5-yl)methyl]acetamide
CID 16189217
N,N-dibutyl-3-phenyl-1,2-oxazole-5-carboxamide
CID 54770484
N,N-dipentyl-3-phenyl-1,2-oxazole-5-carboxamide
CID 54770485
(2R)-N-[(3-butyl-1,2-oxazol-5-yl)methyl]-2,4-dihydroxy-3,3-dimethylbutanamide
CID 164615120
(2R)-2,4-dihydroxy-3,3-dimethyl-N-[(3-pentyl-1,2-oxazol-5-yl)methyl]butanamide
CID 164623436

Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-N-[3-(dimethylamino)-3-oxopropyl]-1,2-oxazole-5-carboxamide?
The IUPAC name of 3-cyclohexyl-N-[3-(dimethylamino)-3-oxopropyl]-1,2-oxazole-5-carboxamide (CID 162666195) is 3-cyclohexyl-N-[3-(dimethylamino)-3-oxopropyl]-1,2-oxazole-5-carboxamide.
What is the SMILES notation for 3-cyclohexyl-N-[3-(dimethylamino)-3-oxopropyl]-1,2-oxazole-5-carboxamide?
The canonical SMILES for 3-cyclohexyl-N-[3-(dimethylamino)-3-oxopropyl]-1,2-oxazole-5-carboxamide is CN(C)C(=O)CCNC(=O)c1cc(C2CCCCC2)no1.
What is the InChIKey of 3-cyclohexyl-N-[3-(dimethylamino)-3-oxopropyl]-1,2-oxazole-5-carboxamide?
The InChIKey is KERAGXXEMSVVGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O3/c1-18(2)14(19)8-9-16-15(20)13-10-12(17-21-13)11-6-4-3-5-7-11/h10-11H,3-9H2,1-2H3,(H,16,20).
What are the key properties of 3-cyclohexyl-N-[3-(dimethylamino)-3-oxopropyl]-1,2-oxazole-5-carboxamide?
3-cyclohexyl-N-[3-(dimethylamino)-3-oxopropyl]-1,2-oxazole-5-carboxamide has a molecular weight of 293.37 g/mol, XLogP of 1.93, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-N-[3-(dimethylamino)-3-oxopropyl]-1,2-oxazole-5-carboxamide is sourced from PubChem (CID 162666195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).