3-(4-methylpiperidin-1-yl)-1,2-oxazole-5-carboxamide

C10H15N3O2 — CID 102287096

IUPAC3-(4-methylpiperidin-1-yl)-1,2-oxazole-5-carboxamide
SMILESCC1CCN(c2cc(C(N)=O)on2)CC1
InChIInChI=1S/C10H15N3O2/c1-7-2-4-13(5-3-7)9-6-8(10(11)14)15-12-9/h6-7H,2-5H2,1H3,(H2,11,14)
InChIKeyBDKSZFZSBITZRX-UHFFFAOYSA-N
MW209.25 g/mol
LogP1.01
Rot. Bonds2

About 3-(4-methylpiperidin-1-yl)-1,2-oxazole-5-carboxamide

3-(4-methylpiperidin-1-yl)-1,2-oxazole-5-carboxamide (PubChem CID 102287096) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is 3-(4-methylpiperidin-1-yl)-1,2-oxazole-5-carboxamide.

Molecular Properties

Compound Name3-(4-methylpiperidin-1-yl)-1,2-oxazole-5-carboxamide
PubChem CID102287096
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Name3-(4-methylpiperidin-1-yl)-1,2-oxazole-5-carboxamide
SMILESCC1CCN(c2cc(C(N)=O)on2)CC1
InChIInChI=1S/C10H15N3O2/c1-7-2-4-13(5-3-7)9-6-8(10(11)14)15-12-9/h6-7H,2-5H2,1H3,(H2,11,14)
InChIKeyBDKSZFZSBITZRX-UHFFFAOYSA-N
XLogP1.01
TPSA72.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(4-methylpiperidin-1-yl)-1,2-oxazole-5-carboxamide?
The IUPAC name of 3-(4-methylpiperidin-1-yl)-1,2-oxazole-5-carboxamide (CID 102287096) is 3-(4-methylpiperidin-1-yl)-1,2-oxazole-5-carboxamide.
What is the SMILES notation for 3-(4-methylpiperidin-1-yl)-1,2-oxazole-5-carboxamide?
The canonical SMILES for 3-(4-methylpiperidin-1-yl)-1,2-oxazole-5-carboxamide is CC1CCN(c2cc(C(N)=O)on2)CC1.
What is the InChIKey of 3-(4-methylpiperidin-1-yl)-1,2-oxazole-5-carboxamide?
The InChIKey is BDKSZFZSBITZRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-7-2-4-13(5-3-7)9-6-8(10(11)14)15-12-9/h6-7H,2-5H2,1H3,(H2,11,14).
What are the key properties of 3-(4-methylpiperidin-1-yl)-1,2-oxazole-5-carboxamide?
3-(4-methylpiperidin-1-yl)-1,2-oxazole-5-carboxamide has a molecular weight of 209.25 g/mol, XLogP of 1.01, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methylpiperidin-1-yl)-1,2-oxazole-5-carboxamide is sourced from PubChem (CID 102287096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).