4-methyl-N-(1,2-oxazol-5-ylmethyl)piperidine-4-carboxamide

C11H17N3O2 — CID 106416927

IUPAC4-methyl-N-(1,2-oxazol-5-ylmethyl)piperidine-4-carboxamide
SMILESCC1(C(=O)NCc2ccno2)CCNCC1
InChIInChI=1S/C11H17N3O2/c1-11(3-6-12-7-4-11)10(15)13-8-9-2-5-14-16-9/h2,5,12H,3-4,6-8H2,1H3,(H,13,15)
InChIKeyQXCFSEXWAFKJSJ-UHFFFAOYSA-N
MW223.28 g/mol
LogP0.68
Rot. Bonds3

About 4-methyl-N-(1,2-oxazol-5-ylmethyl)piperidine-4-carboxamide

4-methyl-N-(1,2-oxazol-5-ylmethyl)piperidine-4-carboxamide (PubChem CID 106416927) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is 4-methyl-N-(1,2-oxazol-5-ylmethyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name4-methyl-N-(1,2-oxazol-5-ylmethyl)piperidine-4-carboxamide
PubChem CID106416927
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC Name4-methyl-N-(1,2-oxazol-5-ylmethyl)piperidine-4-carboxamide
SMILESCC1(C(=O)NCc2ccno2)CCNCC1
InChIInChI=1S/C11H17N3O2/c1-11(3-6-12-7-4-11)10(15)13-8-9-2-5-14-16-9/h2,5,12H,3-4,6-8H2,1H3,(H,13,15)
InChIKeyQXCFSEXWAFKJSJ-UHFFFAOYSA-N
XLogP0.68
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 50.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(aminomethyl)-N-(1,2-oxazol-5-ylmethyl)cyclopropane-1-carboxamide
CID 106416951
4-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidine-4-carboxamide
CID 63122936
N-(1,2-oxazol-5-ylmethyl)acetamide
CID 103939766
4-methyl-N-[(1-methylimidazol-2-yl)methyl]piperidine-4-carboxamide
CID 63293989
1-cyano-N-(1,2-oxazol-5-ylmethyl)cyclohexane-1-carboxamide
CID 103939777
N-[[4-(hydroxymethyl)phenyl]methyl]-3-methylpyrrolidine-3-carboxamide
CID 107231126
methyl 4-[[(4-methylpiperidine-4-carbonyl)amino]methyl]benzoate
CID 63122386
4-methyl-N-(2-pyridin-4-ylethyl)piperidine-4-carboxamide
CID 55177553
1-tert-butyl-3-(1,2-oxazol-5-ylmethyl)urea
CID 106415604
1-(N'-hydroxycarbamimidoyl)-N-(1,2-oxazol-5-ylmethyl)cyclohexane-1-carboxamide
CID 106421900
3-methyl-N-[[4-(1H-pyrazol-5-yl)phenyl]methyl]pyrrolidine-3-carboxamide
CID 63141348
N-[[3-(methoxymethyl)phenyl]methyl]-4-methylpiperidine-4-carboxamide
CID 63122588

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(1,2-oxazol-5-ylmethyl)piperidine-4-carboxamide?
The IUPAC name of 4-methyl-N-(1,2-oxazol-5-ylmethyl)piperidine-4-carboxamide (CID 106416927) is 4-methyl-N-(1,2-oxazol-5-ylmethyl)piperidine-4-carboxamide.
What is the SMILES notation for 4-methyl-N-(1,2-oxazol-5-ylmethyl)piperidine-4-carboxamide?
The canonical SMILES for 4-methyl-N-(1,2-oxazol-5-ylmethyl)piperidine-4-carboxamide is CC1(C(=O)NCc2ccno2)CCNCC1.
What is the InChIKey of 4-methyl-N-(1,2-oxazol-5-ylmethyl)piperidine-4-carboxamide?
The InChIKey is QXCFSEXWAFKJSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c1-11(3-6-12-7-4-11)10(15)13-8-9-2-5-14-16-9/h2,5,12H,3-4,6-8H2,1H3,(H,13,15).
What are the key properties of 4-methyl-N-(1,2-oxazol-5-ylmethyl)piperidine-4-carboxamide?
4-methyl-N-(1,2-oxazol-5-ylmethyl)piperidine-4-carboxamide has a molecular weight of 223.28 g/mol, XLogP of 0.68, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(1,2-oxazol-5-ylmethyl)piperidine-4-carboxamide is sourced from PubChem (CID 106416927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).