1-[4-[1-(furan-2-yl)ethylamino]piperidin-1-yl]-2-methoxyethanone

C14H22N2O3 — CID 43747621

IUPAC1-[4-[1-(furan-2-yl)ethylamino]piperidin-1-yl]-2-methoxyethanone
SMILESCOCC(=O)N1CCC(NC(C)c2ccco2)CC1
InChIInChI=1S/C14H22N2O3/c1-11(13-4-3-9-19-13)15-12-5-7-16(8-6-12)14(17)10-18-2/h3-4,9,11-12,15H,5-8,10H2,1-2H3
InChIKeyFVBJCUGRTSYLBR-UHFFFAOYSA-N
MW266.34 g/mol
LogP1.57
Rot. Bonds5

About 1-[4-[1-(furan-2-yl)ethylamino]piperidin-1-yl]-2-methoxyethanone

1-[4-[1-(furan-2-yl)ethylamino]piperidin-1-yl]-2-methoxyethanone (PubChem CID 43747621) has the molecular formula C14H22N2O3 and a molecular weight of 266.34 g/mol. Its IUPAC name is 1-[4-[1-(furan-2-yl)ethylamino]piperidin-1-yl]-2-methoxyethanone.

Molecular Properties

Compound Name1-[4-[1-(furan-2-yl)ethylamino]piperidin-1-yl]-2-methoxyethanone
PubChem CID43747621
Molecular FormulaC14H22N2O3
Molecular Weight266.34 g/mol
Exact Mass266.16
IUPAC Name1-[4-[1-(furan-2-yl)ethylamino]piperidin-1-yl]-2-methoxyethanone
SMILESCOCC(=O)N1CCC(NC(C)c2ccco2)CC1
InChIInChI=1S/C14H22N2O3/c1-11(13-4-3-9-19-13)15-12-5-7-16(8-6-12)14(17)10-18-2/h3-4,9,11-12,15H,5-8,10H2,1-2H3
InChIKeyFVBJCUGRTSYLBR-UHFFFAOYSA-N
XLogP1.57
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[[(1S)-1-(furan-2-yl)ethyl]amino]-N,N-dimethylpiperidine-1-carboxamide
CID 83261936
2-methoxy-1-[4-[1-(4-methylphenyl)ethylamino]piperidin-1-yl]ethanone
CID 43747615
N-[(1S)-1-(furan-2-yl)ethyl]-1-methylpiperidin-4-amine
CID 81403796
2-methoxy-1-[4-(propan-2-ylamino)piperidin-1-yl]ethanone
CID 43747632
1-[4-[1-(3-bromothiophen-2-yl)ethylamino]piperidin-1-yl]-2-methoxyethanone
CID 43791438
N-[(1R)-1-(furan-2-yl)ethyl]-1-(3-methylbut-2-enyl)piperidin-4-amine
CID 81403840
2-[[(1S)-1-(furan-2-yl)ethyl]amino]-1-pyrrolidin-1-ylethanone
CID 81400744
N-[(1S)-1-(furan-2-yl)ethyl]-1-(2,2,2-trifluoroethyl)piperidin-4-amine
CID 81403823
N-[1-(furan-2-yl)ethyl]-1-methylazepan-4-amine
CID 65070258
2-methoxy-1-[4-(3-methylpentan-2-ylamino)piperidin-1-yl]ethanone
CID 43747506
1-[4-(1-aminopropan-2-ylamino)piperidin-1-yl]-2-methoxyethanone
CID 103388974
2-[[(1R)-1-(furan-2-yl)ethyl]amino]-1-(4-methylpiperazin-1-yl)ethanone
CID 81400767

Frequently Asked Questions

What is the IUPAC name of 1-[4-[1-(furan-2-yl)ethylamino]piperidin-1-yl]-2-methoxyethanone?
The IUPAC name of 1-[4-[1-(furan-2-yl)ethylamino]piperidin-1-yl]-2-methoxyethanone (CID 43747621) is 1-[4-[1-(furan-2-yl)ethylamino]piperidin-1-yl]-2-methoxyethanone.
What is the SMILES notation for 1-[4-[1-(furan-2-yl)ethylamino]piperidin-1-yl]-2-methoxyethanone?
The canonical SMILES for 1-[4-[1-(furan-2-yl)ethylamino]piperidin-1-yl]-2-methoxyethanone is COCC(=O)N1CCC(NC(C)c2ccco2)CC1.
What is the InChIKey of 1-[4-[1-(furan-2-yl)ethylamino]piperidin-1-yl]-2-methoxyethanone?
The InChIKey is FVBJCUGRTSYLBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O3/c1-11(13-4-3-9-19-13)15-12-5-7-16(8-6-12)14(17)10-18-2/h3-4,9,11-12,15H,5-8,10H2,1-2H3.
What are the key properties of 1-[4-[1-(furan-2-yl)ethylamino]piperidin-1-yl]-2-methoxyethanone?
1-[4-[1-(furan-2-yl)ethylamino]piperidin-1-yl]-2-methoxyethanone has a molecular weight of 266.34 g/mol, XLogP of 1.57, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[1-(furan-2-yl)ethylamino]piperidin-1-yl]-2-methoxyethanone is sourced from PubChem (CID 43747621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).