N-ethyl-5-methyl-N-piperidin-4-yl-1,2-oxazole-3-carboxamide

C12H19N3O2 — CID 60805893

IUPACN-ethyl-5-methyl-N-piperidin-4-yl-1,2-oxazole-3-carboxamide
SMILESCCN(C(=O)c1cc(C)on1)C1CCNCC1
InChIInChI=1S/C12H19N3O2/c1-3-15(10-4-6-13-7-5-10)12(16)11-8-9(2)17-14-11/h8,10,13H,3-7H2,1-2H3
InChIKeyZNJQEHQCUBWXJJ-UHFFFAOYSA-N
MW237.30 g/mol
LogP1.20
Rot. Bonds3

About N-ethyl-5-methyl-N-piperidin-4-yl-1,2-oxazole-3-carboxamide

N-ethyl-5-methyl-N-piperidin-4-yl-1,2-oxazole-3-carboxamide (PubChem CID 60805893) has the molecular formula C12H19N3O2 and a molecular weight of 237.30 g/mol. Its IUPAC name is N-ethyl-5-methyl-N-piperidin-4-yl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-ethyl-5-methyl-N-piperidin-4-yl-1,2-oxazole-3-carboxamide
PubChem CID60805893
Molecular FormulaC12H19N3O2
Molecular Weight237.30 g/mol
Exact Mass237.15
IUPAC NameN-ethyl-5-methyl-N-piperidin-4-yl-1,2-oxazole-3-carboxamide
SMILESCCN(C(=O)c1cc(C)on1)C1CCNCC1
InChIInChI=1S/C12H19N3O2/c1-3-15(10-4-6-13-7-5-10)12(16)11-8-9(2)17-14-11/h8,10,13H,3-7H2,1-2H3
InChIKeyZNJQEHQCUBWXJJ-UHFFFAOYSA-N
XLogP1.20
TPSA58.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-5-methyl-N-(piperidin-4-ylmethyl)-1,2-oxazole-3-carboxamide
CID 79720535
N-cyclopropyl-N-(2-hydroxyethyl)-5-methyl-1,2-oxazole-3-carboxamide
CID 43577020
N-ethyl-2-methyl-N-piperidin-4-yl-1,3-thiazole-4-carboxamide
CID 65198571
3,5-dichloro-N-ethyl-N-piperidin-4-ylbenzamide
CID 60806736
N-ethyl-5-methyl-N-[(3S)-1-[(1S)-1-phenylethyl]pyrrolidin-3-yl]-1,2-oxazole-3-carboxamide
CID 95286765
5-(methoxymethyl)-N-piperidin-4-yl-N-propyl-1,2-oxazole-3-carboxamide;hydrochloride
CID 119824672
3-[cyclopentyl(ethyl)carbamoyl]-1,2-oxazole-5-carboxylic acid
CID 107369216
4-chloro-N-ethyl-N-piperidin-4-ylbenzamide
CID 54923441
N-ethyl-2,4-dimethyl-N-piperidin-4-ylbenzamide
CID 60807085
N-ethyl-1-methyl-N-piperidin-4-ylpyrazole-4-carboxamide
CID 60807095
N-ethyl-N,5-dimethyl-1,2-oxazole-3-carboxamide;hydrochloride
CID 130615848
N-ethyl-2,5-dimethyl-N-pyrrolidin-3-ylfuran-3-carboxamide
CID 60807715

Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-methyl-N-piperidin-4-yl-1,2-oxazole-3-carboxamide?
The IUPAC name of N-ethyl-5-methyl-N-piperidin-4-yl-1,2-oxazole-3-carboxamide (CID 60805893) is N-ethyl-5-methyl-N-piperidin-4-yl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-ethyl-5-methyl-N-piperidin-4-yl-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-ethyl-5-methyl-N-piperidin-4-yl-1,2-oxazole-3-carboxamide is CCN(C(=O)c1cc(C)on1)C1CCNCC1.
What is the InChIKey of N-ethyl-5-methyl-N-piperidin-4-yl-1,2-oxazole-3-carboxamide?
The InChIKey is ZNJQEHQCUBWXJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2/c1-3-15(10-4-6-13-7-5-10)12(16)11-8-9(2)17-14-11/h8,10,13H,3-7H2,1-2H3.
What are the key properties of N-ethyl-5-methyl-N-piperidin-4-yl-1,2-oxazole-3-carboxamide?
N-ethyl-5-methyl-N-piperidin-4-yl-1,2-oxazole-3-carboxamide has a molecular weight of 237.30 g/mol, XLogP of 1.20, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-methyl-N-piperidin-4-yl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 60805893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).