N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-piperidin-1-ylacetamide

C12H19N3O2 — CID 3053718

IUPACN-(3,4-dimethyl-1,2-oxazol-5-yl)-2-piperidin-1-ylacetamide
SMILESCc1noc(NC(=O)CN2CCCCC2)c1C
InChIInChI=1S/C12H19N3O2/c1-9-10(2)14-17-12(9)13-11(16)8-15-6-4-3-5-7-15/h3-8H2,1-2H3,(H,13,16)
InChIKeyFQXJNXKJOUKOKK-UHFFFAOYSA-N
MW237.30 g/mol
LogP1.72
Rot. Bonds3

About N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-piperidin-1-ylacetamide

N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-piperidin-1-ylacetamide (PubChem CID 3053718) has the molecular formula C12H19N3O2 and a molecular weight of 237.30 g/mol. Its IUPAC name is N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-piperidin-1-ylacetamide.

Molecular Properties

Compound NameN-(3,4-dimethyl-1,2-oxazol-5-yl)-2-piperidin-1-ylacetamide
PubChem CID3053718
Molecular FormulaC12H19N3O2
Molecular Weight237.30 g/mol
Exact Mass237.15
IUPAC NameN-(3,4-dimethyl-1,2-oxazol-5-yl)-2-piperidin-1-ylacetamide
SMILESCc1noc(NC(=O)CN2CCCCC2)c1C
InChIInChI=1S/C12H19N3O2/c1-9-10(2)14-17-12(9)13-11(16)8-15-6-4-3-5-7-15/h3-8H2,1-2H3,(H,13,16)
InChIKeyFQXJNXKJOUKOKK-UHFFFAOYSA-N
XLogP1.72
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 ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-piperidin-1-ylacetamide?
The IUPAC name of N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-piperidin-1-ylacetamide (CID 3053718) is N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-piperidin-1-ylacetamide.
What is the SMILES notation for N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-piperidin-1-ylacetamide?
The canonical SMILES for N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-piperidin-1-ylacetamide is Cc1noc(NC(=O)CN2CCCCC2)c1C.
What is the InChIKey of N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-piperidin-1-ylacetamide?
The InChIKey is FQXJNXKJOUKOKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2/c1-9-10(2)14-17-12(9)13-11(16)8-15-6-4-3-5-7-15/h3-8H2,1-2H3,(H,13,16).
What are the key properties of N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-piperidin-1-ylacetamide?
N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-piperidin-1-ylacetamide has a molecular weight of 237.30 g/mol, XLogP of 1.72, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-piperidin-1-ylacetamide is sourced from PubChem (CID 3053718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).