1-[3-(5-methylfuran-2-yl)butyl]piperidine-4-carboxamide

C15H24N2O2 — CID 44828082

IUPAC1-[3-(5-methylfuran-2-yl)butyl]piperidine-4-carboxamide
SMILESCc1ccc(C(C)CCN2CCC(C(N)=O)CC2)o1
InChIInChI=1S/C15H24N2O2/c1-11(14-4-3-12(2)19-14)5-8-17-9-6-13(7-10-17)15(16)18/h3-4,11,13H,5-10H2,1-2H3,(H2,16,18)
InChIKeyPAGDXFMKAHOFEV-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.28
Rot. Bonds5

About 1-[3-(5-methylfuran-2-yl)butyl]piperidine-4-carboxamide

1-[3-(5-methylfuran-2-yl)butyl]piperidine-4-carboxamide (PubChem CID 44828082) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 1-[3-(5-methylfuran-2-yl)butyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-[3-(5-methylfuran-2-yl)butyl]piperidine-4-carboxamide
PubChem CID44828082
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name1-[3-(5-methylfuran-2-yl)butyl]piperidine-4-carboxamide
SMILESCc1ccc(C(C)CCN2CCC(C(N)=O)CC2)o1
InChIInChI=1S/C15H24N2O2/c1-11(14-4-3-12(2)19-14)5-8-17-9-6-13(7-10-17)15(16)18/h3-4,11,13H,5-10H2,1-2H3,(H2,16,18)
InChIKeyPAGDXFMKAHOFEV-UHFFFAOYSA-N
XLogP2.28
TPSA59.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[3-[1-(5-methylfuran-2-yl)ethylcarbamoylamino]propyl]piperidine-4-carboxamide
CID 71895053
[4-[1-[(3R)-3-(5-methylfuran-2-yl)butyl]piperidin-4-yl]oxyphenyl]-pyrrolidin-1-ylmethanone
CID 25446255
1-[3-(5-methylfuran-2-yl)butyl]-4-(1H-pyrazol-5-yl)piperidine
CID 74236751
1-[2-amino-2-(5-methylfuran-2-yl)ethyl]piperidine-3-carboxamide
CID 16794425
ethyl 4-(2-methoxyethyl)-1-[(3S)-3-(5-methylfuran-2-yl)butyl]piperidine-4-carboxylate
CID 25461112
N-[2-[1-[(3S)-3-(5-methylfuran-2-yl)butyl]piperidin-4-yl]pyrazol-3-yl]-2-phenylacetamide
CID 42566213
ethyl 4-[[(2R)-6-[(3R)-3-(5-methylfuran-2-yl)butyl]-6-azaspiro[2.5]octane-2-carbonyl]amino]piperidine-1-carboxylate
CID 26282736
5-cyclopropyl-3-[[1-[3-(5-methylfuran-2-yl)butyl]piperidin-4-yl]methyl]-1,2,4-oxadiazole
CID 74239558
4-imidazol-1-yl-1-[(3R)-3-(5-methylfuran-2-yl)butyl]piperidine-4-carboxylic acid
CID 95872164
1-propylpiperidine-4-carboxamide
CID 18678413
5-methyl-3-[[4-[(3S)-3-(5-methylfuran-2-yl)butyl]piperazin-1-yl]methyl]-1,2,4-oxadiazole
CID 99927931
N-[[5-[3-(5-methylfuran-2-yl)butyl]-4,6,7,8-tetrahydropyrazolo[1,5-a][1,4]diazepin-2-yl]methyl]cyclobutanecarboxamide
CID 72888585

Frequently Asked Questions

What is the IUPAC name of 1-[3-(5-methylfuran-2-yl)butyl]piperidine-4-carboxamide?
The IUPAC name of 1-[3-(5-methylfuran-2-yl)butyl]piperidine-4-carboxamide (CID 44828082) is 1-[3-(5-methylfuran-2-yl)butyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-[3-(5-methylfuran-2-yl)butyl]piperidine-4-carboxamide?
The canonical SMILES for 1-[3-(5-methylfuran-2-yl)butyl]piperidine-4-carboxamide is Cc1ccc(C(C)CCN2CCC(C(N)=O)CC2)o1.
What is the InChIKey of 1-[3-(5-methylfuran-2-yl)butyl]piperidine-4-carboxamide?
The InChIKey is PAGDXFMKAHOFEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-11(14-4-3-12(2)19-14)5-8-17-9-6-13(7-10-17)15(16)18/h3-4,11,13H,5-10H2,1-2H3,(H2,16,18).
What are the key properties of 1-[3-(5-methylfuran-2-yl)butyl]piperidine-4-carboxamide?
1-[3-(5-methylfuran-2-yl)butyl]piperidine-4-carboxamide has a molecular weight of 264.37 g/mol, XLogP of 2.28, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(5-methylfuran-2-yl)butyl]piperidine-4-carboxamide is sourced from PubChem (CID 44828082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).