1-[4-[4-(furan-2-yl)butan-2-ylamino]piperidin-1-yl]ethanone

C15H24N2O2 — CID 43224097

IUPAC1-[4-[4-(furan-2-yl)butan-2-ylamino]piperidin-1-yl]ethanone
SMILESCC(=O)N1CCC(NC(C)CCc2ccco2)CC1
InChIInChI=1S/C15H24N2O2/c1-12(5-6-15-4-3-11-19-15)16-14-7-9-17(10-8-14)13(2)18/h3-4,11-12,14,16H,5-10H2,1-2H3
InChIKeyQRFYRNXAOJQNRT-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.20
Rot. Bonds5

About 1-[4-[4-(furan-2-yl)butan-2-ylamino]piperidin-1-yl]ethanone

1-[4-[4-(furan-2-yl)butan-2-ylamino]piperidin-1-yl]ethanone (PubChem CID 43224097) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 1-[4-[4-(furan-2-yl)butan-2-ylamino]piperidin-1-yl]ethanone.

Molecular Properties

Compound Name1-[4-[4-(furan-2-yl)butan-2-ylamino]piperidin-1-yl]ethanone
PubChem CID43224097
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name1-[4-[4-(furan-2-yl)butan-2-ylamino]piperidin-1-yl]ethanone
SMILESCC(=O)N1CCC(NC(C)CCc2ccco2)CC1
InChIInChI=1S/C15H24N2O2/c1-12(5-6-15-4-3-11-19-15)16-14-7-9-17(10-8-14)13(2)18/h3-4,11-12,14,16H,5-10H2,1-2H3
InChIKeyQRFYRNXAOJQNRT-UHFFFAOYSA-N
XLogP2.20
TPSA45.48 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 ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[4-[4-(furan-2-yl)butan-2-ylamino]piperidin-1-yl]ethanone with MolForge

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Related Compounds

furan-3-yl-[4-[[(2R)-4-(furan-2-yl)butan-2-yl]amino]piperidin-1-yl]methanone
CID 97229211
1-ethylsulfonyl-N-[4-(furan-2-yl)butan-2-yl]piperidin-4-amine
CID 43478927
trans-(1R,2R)-2-[4-[[(2R)-4-(furan-2-yl)butan-2-yl]amino]piperidin-1-yl]cyclohexan-1-ol
CID 124726359
4-ethyl-N-[4-(furan-2-yl)butan-2-yl]cycloheptan-1-amine
CID 65082213
1-acetyl-N-[2-(furan-2-yl)ethyl]piperidine-4-carboxamide
CID 110745476
N-[4-(furan-2-yl)butan-2-yl]oxan-3-amine
CID 63360149
(3R)-1-[4-(furan-2-yl)butan-2-ylcarbamoyl]piperidine-3-carboxylic acid
CID 81128264
N-[4-(furan-2-yl)butan-2-yl]-3-methoxycyclobutan-1-amine
CID 104584627
3-(furan-2-yl)-1-[4-(methylamino)piperidin-1-yl]propan-1-one
CID 54923480
N-[4-(furan-2-yl)butan-2-yl]-3-(4-methylphenyl)cyclobutan-1-amine
CID 43634568
N-[4-(furan-2-yl)butan-2-yl]-4-(thiophen-2-ylsulfonylamino)piperidine-1-carboxamide
CID 55569665
N-[4-(furan-2-yl)butan-2-yl]-3-oxobutanamide
CID 61251024

Frequently Asked Questions

What is the IUPAC name of 1-[4-[4-(furan-2-yl)butan-2-ylamino]piperidin-1-yl]ethanone?
The IUPAC name of 1-[4-[4-(furan-2-yl)butan-2-ylamino]piperidin-1-yl]ethanone (CID 43224097) is 1-[4-[4-(furan-2-yl)butan-2-ylamino]piperidin-1-yl]ethanone.
What is the SMILES notation for 1-[4-[4-(furan-2-yl)butan-2-ylamino]piperidin-1-yl]ethanone?
The canonical SMILES for 1-[4-[4-(furan-2-yl)butan-2-ylamino]piperidin-1-yl]ethanone is CC(=O)N1CCC(NC(C)CCc2ccco2)CC1.
What is the InChIKey of 1-[4-[4-(furan-2-yl)butan-2-ylamino]piperidin-1-yl]ethanone?
The InChIKey is QRFYRNXAOJQNRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-12(5-6-15-4-3-11-19-15)16-14-7-9-17(10-8-14)13(2)18/h3-4,11-12,14,16H,5-10H2,1-2H3.
What are the key properties of 1-[4-[4-(furan-2-yl)butan-2-ylamino]piperidin-1-yl]ethanone?
1-[4-[4-(furan-2-yl)butan-2-ylamino]piperidin-1-yl]ethanone has a molecular weight of 264.37 g/mol, XLogP of 2.20, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[4-(furan-2-yl)butan-2-ylamino]piperidin-1-yl]ethanone is sourced from PubChem (CID 43224097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).