4-methyl-N-(2-piperidin-3-ylethyl)-1,2-oxazole-5-carboxamide

C12H19N3O2 — CID 66334813

IUPAC4-methyl-N-(2-piperidin-3-ylethyl)-1,2-oxazole-5-carboxamide
SMILESCc1cnoc1C(=O)NCCC1CCCNC1
InChIInChI=1S/C12H19N3O2/c1-9-7-15-17-11(9)12(16)14-6-4-10-3-2-5-13-8-10/h7,10,13H,2-6,8H2,1H3,(H,14,16)
InChIKeyGIDVQFVVVLAZLD-UHFFFAOYSA-N
MW237.30 g/mol
LogP1.10
Rot. Bonds4

About 4-methyl-N-(2-piperidin-3-ylethyl)-1,2-oxazole-5-carboxamide

4-methyl-N-(2-piperidin-3-ylethyl)-1,2-oxazole-5-carboxamide (PubChem CID 66334813) has the molecular formula C12H19N3O2 and a molecular weight of 237.30 g/mol. Its IUPAC name is 4-methyl-N-(2-piperidin-3-ylethyl)-1,2-oxazole-5-carboxamide.

Molecular Properties

Compound Name4-methyl-N-(2-piperidin-3-ylethyl)-1,2-oxazole-5-carboxamide
PubChem CID66334813
Molecular FormulaC12H19N3O2
Molecular Weight237.30 g/mol
Exact Mass237.15
IUPAC Name4-methyl-N-(2-piperidin-3-ylethyl)-1,2-oxazole-5-carboxamide
SMILESCc1cnoc1C(=O)NCCC1CCCNC1
InChIInChI=1S/C12H19N3O2/c1-9-7-15-17-11(9)12(16)14-6-4-10-3-2-5-13-8-10/h7,10,13H,2-6,8H2,1H3,(H,14,16)
InChIKeyGIDVQFVVVLAZLD-UHFFFAOYSA-N
XLogP1.10
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(2-piperidin-3-ylethyl)-1,2-oxazole-5-carboxamide?
The IUPAC name of 4-methyl-N-(2-piperidin-3-ylethyl)-1,2-oxazole-5-carboxamide (CID 66334813) is 4-methyl-N-(2-piperidin-3-ylethyl)-1,2-oxazole-5-carboxamide.
What is the SMILES notation for 4-methyl-N-(2-piperidin-3-ylethyl)-1,2-oxazole-5-carboxamide?
The canonical SMILES for 4-methyl-N-(2-piperidin-3-ylethyl)-1,2-oxazole-5-carboxamide is Cc1cnoc1C(=O)NCCC1CCCNC1.
What is the InChIKey of 4-methyl-N-(2-piperidin-3-ylethyl)-1,2-oxazole-5-carboxamide?
The InChIKey is GIDVQFVVVLAZLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2/c1-9-7-15-17-11(9)12(16)14-6-4-10-3-2-5-13-8-10/h7,10,13H,2-6,8H2,1H3,(H,14,16).
What are the key properties of 4-methyl-N-(2-piperidin-3-ylethyl)-1,2-oxazole-5-carboxamide?
4-methyl-N-(2-piperidin-3-ylethyl)-1,2-oxazole-5-carboxamide has a molecular weight of 237.30 g/mol, XLogP of 1.10, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(2-piperidin-3-ylethyl)-1,2-oxazole-5-carboxamide is sourced from PubChem (CID 66334813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).