5-methyl-N-piperidin-4-yl-N-propyl-1,3-oxazole-4-carboxamide

C13H21N3O2 — CID 119825428

IUPAC5-methyl-N-piperidin-4-yl-N-propyl-1,3-oxazole-4-carboxamide
SMILESCCCN(C(=O)c1ncoc1C)C1CCNCC1
InChIInChI=1S/C13H21N3O2/c1-3-8-16(11-4-6-14-7-5-11)13(17)12-10(2)18-9-15-12/h9,11,14H,3-8H2,1-2H3
InChIKeyOTYWDDLOADBHCX-UHFFFAOYSA-N
MW251.33 g/mol
LogP1.59
Rot. Bonds4

About 5-methyl-N-piperidin-4-yl-N-propyl-1,3-oxazole-4-carboxamide

5-methyl-N-piperidin-4-yl-N-propyl-1,3-oxazole-4-carboxamide (PubChem CID 119825428) has the molecular formula C13H21N3O2 and a molecular weight of 251.33 g/mol. Its IUPAC name is 5-methyl-N-piperidin-4-yl-N-propyl-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound Name5-methyl-N-piperidin-4-yl-N-propyl-1,3-oxazole-4-carboxamide
PubChem CID119825428
Molecular FormulaC13H21N3O2
Molecular Weight251.33 g/mol
Exact Mass251.16
IUPAC Name5-methyl-N-piperidin-4-yl-N-propyl-1,3-oxazole-4-carboxamide
SMILESCCCN(C(=O)c1ncoc1C)C1CCNCC1
InChIInChI=1S/C13H21N3O2/c1-3-8-16(11-4-6-14-7-5-11)13(17)12-10(2)18-9-15-12/h9,11,14H,3-8H2,1-2H3
InChIKeyOTYWDDLOADBHCX-UHFFFAOYSA-N
XLogP1.59
TPSA58.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-methyl-N-propyl-N-pyrrolidin-3-yl-1,3-oxazole-4-carboxamide;hydrochloride
CID 119532219
5-methyl-N-piperidin-4-yl-N-propylfuran-2-carboxamide
CID 60805408
3,5-dimethyl-N-piperidin-4-yl-N-propylbenzamide;hydrochloride
CID 119824323
N-piperidin-4-yl-N-propylpyridine-4-carboxamide
CID 54923494
3,5-dimethyl-N-piperidin-4-yl-N-propylfuran-2-carboxamide
CID 119823817
2-(1,2-oxazol-3-yl)-N-piperidin-4-yl-N-propylacetamide;dihydrochloride
CID 91659773
2-(6-methyl-3-pyridinyl)-N-piperidin-4-yl-N-propylacetamide
CID 119825418
2-methyl-N-piperidin-4-yl-N-propylcyclopropane-1-carboxamide
CID 60806583
N-propyl-N-pyrrolidin-3-yl-5-(trifluoromethyl)pyridine-2-carboxamide
CID 115737122
4-ethyl-N-piperidin-4-yl-N-propylbenzamide;hydrochloride
CID 119823008
4-iodo-N-piperidin-4-yl-N-propylbenzamide;hydrochloride
CID 119822992
(E)-3-(furan-2-yl)-N-piperidin-4-yl-N-propylprop-2-enamide
CID 60806754

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-piperidin-4-yl-N-propyl-1,3-oxazole-4-carboxamide?
The IUPAC name of 5-methyl-N-piperidin-4-yl-N-propyl-1,3-oxazole-4-carboxamide (CID 119825428) is 5-methyl-N-piperidin-4-yl-N-propyl-1,3-oxazole-4-carboxamide.
What is the SMILES notation for 5-methyl-N-piperidin-4-yl-N-propyl-1,3-oxazole-4-carboxamide?
The canonical SMILES for 5-methyl-N-piperidin-4-yl-N-propyl-1,3-oxazole-4-carboxamide is CCCN(C(=O)c1ncoc1C)C1CCNCC1.
What is the InChIKey of 5-methyl-N-piperidin-4-yl-N-propyl-1,3-oxazole-4-carboxamide?
The InChIKey is OTYWDDLOADBHCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O2/c1-3-8-16(11-4-6-14-7-5-11)13(17)12-10(2)18-9-15-12/h9,11,14H,3-8H2,1-2H3.
What are the key properties of 5-methyl-N-piperidin-4-yl-N-propyl-1,3-oxazole-4-carboxamide?
5-methyl-N-piperidin-4-yl-N-propyl-1,3-oxazole-4-carboxamide has a molecular weight of 251.33 g/mol, XLogP of 1.59, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-piperidin-4-yl-N-propyl-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 119825428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).