1-(furan-2-ylmethyl)-N-(2-hydroxy-3-phenoxypropyl)piperidine-4-carboxamide

C20H26N2O4 — CID 72923240

IUPAC1-(furan-2-ylmethyl)-N-(2-hydroxy-3-phenoxypropyl)piperidine-4-carboxamide
SMILESO=C(NCC(O)COc1ccccc1)C1CCN(Cc2ccco2)CC1
InChIInChI=1S/C20H26N2O4/c23-17(15-26-18-5-2-1-3-6-18)13-21-20(24)16-8-10-22(11-9-16)14-19-7-4-12-25-19/h1-7,12,16-17,23H,8-11,13-15H2,(H,21,24)
InChIKeyJXLWIQDXMFAKPR-UHFFFAOYSA-N
MW358.44 g/mol
LogP2.05
Rot. Bonds8

About 1-(furan-2-ylmethyl)-N-(2-hydroxy-3-phenoxypropyl)piperidine-4-carboxamide

1-(furan-2-ylmethyl)-N-(2-hydroxy-3-phenoxypropyl)piperidine-4-carboxamide (PubChem CID 72923240) has the molecular formula C20H26N2O4 and a molecular weight of 358.44 g/mol. Its IUPAC name is 1-(furan-2-ylmethyl)-N-(2-hydroxy-3-phenoxypropyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(furan-2-ylmethyl)-N-(2-hydroxy-3-phenoxypropyl)piperidine-4-carboxamide
PubChem CID72923240
Molecular FormulaC20H26N2O4
Molecular Weight358.44 g/mol
Exact Mass358.19
IUPAC Name1-(furan-2-ylmethyl)-N-(2-hydroxy-3-phenoxypropyl)piperidine-4-carboxamide
SMILESO=C(NCC(O)COc1ccccc1)C1CCN(Cc2ccco2)CC1
InChIInChI=1S/C20H26N2O4/c23-17(15-26-18-5-2-1-3-6-18)13-21-20(24)16-8-10-22(11-9-16)14-19-7-4-12-25-19/h1-7,12,16-17,23H,8-11,13-15H2,(H,21,24)
InChIKeyJXLWIQDXMFAKPR-UHFFFAOYSA-N
XLogP2.05
TPSA74.94 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.44
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-(furan-2-ylmethyl)-N-(6-phenoxy-3-pyridinyl)piperidine-4-carboxamide
CID 24793063
N-benzyl-1-[(2R)-3-(furan-2-ylmethoxy)-2-hydroxypropyl]piperidine-4-carboxamide
CID 32603172
2-(2-chlorophenyl)-2-[[1-(furan-2-ylmethyl)piperidine-4-carbonyl]amino]acetic acid
CID 72862619
N-[(1,1-dioxothiolan-3-yl)methyl]-1-(furan-2-ylmethyl)piperidine-4-carboxamide
CID 72887195
1-(furan-2-ylmethyl)-N-[[(3R)-6-phenylmethoxy-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]piperidine-4-carboxamide
CID 153328855
N-(2-ethylsulfanylphenyl)-1-(furan-2-ylmethyl)piperidine-4-carboxamide
CID 131949045
N-[2-[(4-chlorophenyl)methoxy]ethyl]-1-(furan-2-ylmethyl)piperidine-4-carboxamide
CID 72871524
N-[2-(4,6-dimethylpyrimidin-2-yl)ethyl]-1-(furan-2-ylmethyl)piperidine-4-carboxamide
CID 91775679
4-ethoxy-N-[[1-(furan-2-ylmethyl)piperidin-4-yl]methyl]benzamide
CID 16896156
1-(furan-2-ylmethyl)-N-[(2S)-1-pyrazin-2-ylpropan-2-yl]piperidine-4-carboxamide
CID 97190312
1-(furan-2-ylmethyl)-N-[(3-propyl-1,2-oxazol-5-yl)methyl]piperidine-4-carboxamide
CID 72847764
1-[(3-ethoxyphenyl)methyl]-N-[2-(furan-2-ylmethylsulfanyl)ethyl]piperidine-4-carboxamide
CID 43922720

Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-ylmethyl)-N-(2-hydroxy-3-phenoxypropyl)piperidine-4-carboxamide?
The IUPAC name of 1-(furan-2-ylmethyl)-N-(2-hydroxy-3-phenoxypropyl)piperidine-4-carboxamide (CID 72923240) is 1-(furan-2-ylmethyl)-N-(2-hydroxy-3-phenoxypropyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(furan-2-ylmethyl)-N-(2-hydroxy-3-phenoxypropyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(furan-2-ylmethyl)-N-(2-hydroxy-3-phenoxypropyl)piperidine-4-carboxamide is O=C(NCC(O)COc1ccccc1)C1CCN(Cc2ccco2)CC1.
What is the InChIKey of 1-(furan-2-ylmethyl)-N-(2-hydroxy-3-phenoxypropyl)piperidine-4-carboxamide?
The InChIKey is JXLWIQDXMFAKPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O4/c23-17(15-26-18-5-2-1-3-6-18)13-21-20(24)16-8-10-22(11-9-16)14-19-7-4-12-25-19/h1-7,12,16-17,23H,8-11,13-15H2,(H,21,24).
What are the key properties of 1-(furan-2-ylmethyl)-N-(2-hydroxy-3-phenoxypropyl)piperidine-4-carboxamide?
1-(furan-2-ylmethyl)-N-(2-hydroxy-3-phenoxypropyl)piperidine-4-carboxamide has a molecular weight of 358.44 g/mol, XLogP of 2.05, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-ylmethyl)-N-(2-hydroxy-3-phenoxypropyl)piperidine-4-carboxamide is sourced from PubChem (CID 72923240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).