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

C11H17N3O2 — CID 114695110

IUPAC4-methyl-N-(2-methylpiperidin-3-yl)-1,2-oxazole-5-carboxamide
SMILESCc1cnoc1C(=O)NC1CCCNC1C
InChIInChI=1S/C11H17N3O2/c1-7-6-13-16-10(7)11(15)14-9-4-3-5-12-8(9)2/h6,8-9,12H,3-5H2,1-2H3,(H,14,15)
InChIKeyFSSMBQWVTRJRAO-UHFFFAOYSA-N
MW223.28 g/mol
LogP0.85
Rot. Bonds2

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

4-methyl-N-(2-methylpiperidin-3-yl)-1,2-oxazole-5-carboxamide (PubChem CID 114695110) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is 4-methyl-N-(2-methylpiperidin-3-yl)-1,2-oxazole-5-carboxamide.

Molecular Properties

Compound Name4-methyl-N-(2-methylpiperidin-3-yl)-1,2-oxazole-5-carboxamide
PubChem CID114695110
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC Name4-methyl-N-(2-methylpiperidin-3-yl)-1,2-oxazole-5-carboxamide
SMILESCc1cnoc1C(=O)NC1CCCNC1C
InChIInChI=1S/C11H17N3O2/c1-7-6-13-16-10(7)11(15)14-9-4-3-5-12-8(9)2/h6,8-9,12H,3-5H2,1-2H3,(H,14,15)
InChIKeyFSSMBQWVTRJRAO-UHFFFAOYSA-N
XLogP0.85
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 50.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1S,2S)-2-hydroxycyclohexyl]-4-methyl-1,2-oxazole-5-carboxamide
CID 104956999
3-methyl-N-(2-methylpiperidin-3-yl)furan-2-carboxamide;hydrochloride
CID 120577222
2,3-dimethyl-N-(2-methylpiperidin-3-yl)benzamide
CID 79042389
3-bromo-4-methyl-N-(2-methylpiperidin-3-yl)benzamide;hydrochloride
CID 120575414
N-[(2R,3R)-2-methylpiperidin-3-yl]benzamide
CID 124511336
3-methyl-N-(2-methylpiperidin-3-yl)-4-oxo-6,7-dihydro-5H-1-benzofuran-2-carboxamide;hydrochloride
CID 120577651
3,6-dimethyl-N-(2-methylpiperidin-3-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide;hydrochloride
CID 120574234
5-fluoro-N-(2-methylpiperidin-3-yl)pyridine-3-carboxamide;dihydrochloride
CID 120576822
3-methyl-N-[(2S,3S)-2-methylpiperidin-3-yl]benzamide
CID 124515685
2-methyl-N-(2-methylpiperidin-3-yl)-4-propan-2-ylpyrimidine-5-carboxamide;hydrochloride
CID 120575792
2-methyl-N-(2-methylpiperidin-3-yl)-5-nitropyridine-3-carboxamide
CID 120574886
2-methyl-N-(2-methylpiperidin-3-yl)-5-methylsulfanylbenzamide;hydrochloride
CID 120574172

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(2-methylpiperidin-3-yl)-1,2-oxazole-5-carboxamide?
The IUPAC name of 4-methyl-N-(2-methylpiperidin-3-yl)-1,2-oxazole-5-carboxamide (CID 114695110) is 4-methyl-N-(2-methylpiperidin-3-yl)-1,2-oxazole-5-carboxamide.
What is the SMILES notation for 4-methyl-N-(2-methylpiperidin-3-yl)-1,2-oxazole-5-carboxamide?
The canonical SMILES for 4-methyl-N-(2-methylpiperidin-3-yl)-1,2-oxazole-5-carboxamide is Cc1cnoc1C(=O)NC1CCCNC1C.
What is the InChIKey of 4-methyl-N-(2-methylpiperidin-3-yl)-1,2-oxazole-5-carboxamide?
The InChIKey is FSSMBQWVTRJRAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c1-7-6-13-16-10(7)11(15)14-9-4-3-5-12-8(9)2/h6,8-9,12H,3-5H2,1-2H3,(H,14,15).
What are the key properties of 4-methyl-N-(2-methylpiperidin-3-yl)-1,2-oxazole-5-carboxamide?
4-methyl-N-(2-methylpiperidin-3-yl)-1,2-oxazole-5-carboxamide has a molecular weight of 223.28 g/mol, XLogP of 0.85, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(2-methylpiperidin-3-yl)-1,2-oxazole-5-carboxamide is sourced from PubChem (CID 114695110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).