N-methyl-N-(5-methylfuran-2-yl)-2-piperidin-3-ylacetamide

C13H20N2O2 — CID 115160587

IUPACN-methyl-N-(5-methylfuran-2-yl)-2-piperidin-3-ylacetamide
SMILESCc1ccc(N(C)C(=O)CC2CCCNC2)o1
InChIInChI=1S/C13H20N2O2/c1-10-5-6-13(17-10)15(2)12(16)8-11-4-3-7-14-9-11/h5-6,11,14H,3-4,7-9H2,1-2H3
InChIKeyAOEIJZLKBRQEEL-UHFFFAOYSA-N
MW236.31 g/mol
LogP1.94
Rot. Bonds3

About N-methyl-N-(5-methylfuran-2-yl)-2-piperidin-3-ylacetamide

N-methyl-N-(5-methylfuran-2-yl)-2-piperidin-3-ylacetamide (PubChem CID 115160587) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is N-methyl-N-(5-methylfuran-2-yl)-2-piperidin-3-ylacetamide.

Molecular Properties

Compound NameN-methyl-N-(5-methylfuran-2-yl)-2-piperidin-3-ylacetamide
PubChem CID115160587
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC NameN-methyl-N-(5-methylfuran-2-yl)-2-piperidin-3-ylacetamide
SMILESCc1ccc(N(C)C(=O)CC2CCCNC2)o1
InChIInChI=1S/C13H20N2O2/c1-10-5-6-13(17-10)15(2)12(16)8-11-4-3-7-14-9-11/h5-6,11,14H,3-4,7-9H2,1-2H3
InChIKeyAOEIJZLKBRQEEL-UHFFFAOYSA-N
XLogP1.94
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-(5-methylfuran-2-yl)-2-(1-methylpiperazin-2-yl)acetamide
CID 115178391
N-(5-bromo-2-methylphenyl)-N-methyl-2-piperidin-3-ylacetamide
CID 115160585
N-(3-bromophenyl)-N-methyl-2-piperidin-3-ylacetamide
CID 115160586
(3S)-3-[(5-methylfuran-2-yl)methyl]piperidine
CID 130804196
N-[(4-fluorophenyl)methyl]-N-methyl-2-piperidin-3-ylacetamide
CID 55138241
N-methyl-N-(5-methylfuran-2-yl)pyrrolidin-3-amine
CID 115118775
N-methyl-N-[(5-methylfuran-2-yl)methyl]-2-[methyl(piperidin-3-yl)amino]acetamide
CID 63643024
N-[(5-chlorothiophen-2-yl)methyl]-N-methyl-2-piperidin-3-ylacetamide
CID 62675072
N-methyl-N-(2-phenylethyl)-2-piperidin-3-ylacetamide
CID 62674551
N-methyl-N-(2-methylpropyl)-2-piperidin-3-ylacetamide
CID 62690193
1-(4-methylphenyl)-2-piperidin-3-ylethanone
CID 84683077
N-methyl-2-piperidin-3-yl-N-(1-thiophen-2-ylethyl)acetamide
CID 62674552

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(5-methylfuran-2-yl)-2-piperidin-3-ylacetamide?
The IUPAC name of N-methyl-N-(5-methylfuran-2-yl)-2-piperidin-3-ylacetamide (CID 115160587) is N-methyl-N-(5-methylfuran-2-yl)-2-piperidin-3-ylacetamide.
What is the SMILES notation for N-methyl-N-(5-methylfuran-2-yl)-2-piperidin-3-ylacetamide?
The canonical SMILES for N-methyl-N-(5-methylfuran-2-yl)-2-piperidin-3-ylacetamide is Cc1ccc(N(C)C(=O)CC2CCCNC2)o1.
What is the InChIKey of N-methyl-N-(5-methylfuran-2-yl)-2-piperidin-3-ylacetamide?
The InChIKey is AOEIJZLKBRQEEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-10-5-6-13(17-10)15(2)12(16)8-11-4-3-7-14-9-11/h5-6,11,14H,3-4,7-9H2,1-2H3.
What are the key properties of N-methyl-N-(5-methylfuran-2-yl)-2-piperidin-3-ylacetamide?
N-methyl-N-(5-methylfuran-2-yl)-2-piperidin-3-ylacetamide has a molecular weight of 236.31 g/mol, XLogP of 1.94, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(5-methylfuran-2-yl)-2-piperidin-3-ylacetamide is sourced from PubChem (CID 115160587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).