3-ethoxy-N-[3-(furan-2-ylmethoxy)propyl]piperidine-1-carboxamide

C16H26N2O4 — CID 86843944

IUPAC3-ethoxy-N-[3-(furan-2-ylmethoxy)propyl]piperidine-1-carboxamide
SMILESCCOC1CCCN(C(=O)NCCCOCc2ccco2)C1
InChIInChI=1S/C16H26N2O4/c1-2-21-14-6-3-9-18(12-14)16(19)17-8-5-10-20-13-15-7-4-11-22-15/h4,7,11,14H,2-3,5-6,8-10,12-13H2,1H3,(H,17,19)
InChIKeyXIWDRPPRDZSROF-UHFFFAOYSA-N
MW310.39 g/mol
LogP2.40
Rot. Bonds8

About 3-ethoxy-N-[3-(furan-2-ylmethoxy)propyl]piperidine-1-carboxamide

3-ethoxy-N-[3-(furan-2-ylmethoxy)propyl]piperidine-1-carboxamide (PubChem CID 86843944) has the molecular formula C16H26N2O4 and a molecular weight of 310.39 g/mol. Its IUPAC name is 3-ethoxy-N-[3-(furan-2-ylmethoxy)propyl]piperidine-1-carboxamide.

Molecular Properties

Compound Name3-ethoxy-N-[3-(furan-2-ylmethoxy)propyl]piperidine-1-carboxamide
PubChem CID86843944
Molecular FormulaC16H26N2O4
Molecular Weight310.39 g/mol
Exact Mass310.19
IUPAC Name3-ethoxy-N-[3-(furan-2-ylmethoxy)propyl]piperidine-1-carboxamide
SMILESCCOC1CCCN(C(=O)NCCCOCc2ccco2)C1
InChIInChI=1S/C16H26N2O4/c1-2-21-14-6-3-9-18(12-14)16(19)17-8-5-10-20-13-15-7-4-11-22-15/h4,7,11,14H,2-3,5-6,8-10,12-13H2,1H3,(H,17,19)
InChIKeyXIWDRPPRDZSROF-UHFFFAOYSA-N
XLogP2.40
TPSA63.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.39
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-(azepan-1-ylmethyl)-N-[3-(furan-2-ylmethoxy)propyl]piperidine-1-carboxamide
CID 55794043
4-ethoxy-N-[3-(furan-2-ylmethoxy)propyl]-N'-methylpiperidine-1-carboximidamide
CID 111958114
3-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)-N-[3-(furan-2-ylmethoxy)propyl]piperidine-1-carboxamide
CID 75451642
N-[3-(furan-2-ylmethoxy)propyl]-2,3-dimethylmorpholine-4-carboxamide
CID 71916012
(2R)-N-[3-(furan-2-ylmethoxy)propyl]-2-pyridin-4-ylpyrrolidine-1-carboxamide
CID 94041255
(2R)-N-[3-(furan-2-ylmethoxy)propyl]-2-thiophen-3-ylpyrrolidine-1-carboxamide
CID 94030226
N-[3-(furan-2-ylmethoxy)propyl]-1-methylpiperidin-4-amine
CID 28681139
N-[3-(furan-2-ylmethoxy)propyl]-N',3,5-trimethylpiperidine-1-carboximidamide;hydroiodide
CID 111153081
(3R)-1-ethyl-N-[3-(furan-2-ylmethoxy)propyl]-5-oxopyrrolidine-3-carboxamide
CID 94097464
(3S)-N-[3-[benzyl(methyl)amino]-3-oxopropyl]-3-ethoxypiperidine-1-carboxamide
CID 95309425
4-(4-acetyl-2-fluorophenyl)-N-[3-(furan-2-ylmethoxy)propyl]piperazine-1-carboxamide
CID 55793977
4-(3,4-dimethoxyphenyl)sulfonyl-N-[3-(furan-2-ylmethoxy)propyl]piperazine-1-carboxamide
CID 55793914

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-N-[3-(furan-2-ylmethoxy)propyl]piperidine-1-carboxamide?
The IUPAC name of 3-ethoxy-N-[3-(furan-2-ylmethoxy)propyl]piperidine-1-carboxamide (CID 86843944) is 3-ethoxy-N-[3-(furan-2-ylmethoxy)propyl]piperidine-1-carboxamide.
What is the SMILES notation for 3-ethoxy-N-[3-(furan-2-ylmethoxy)propyl]piperidine-1-carboxamide?
The canonical SMILES for 3-ethoxy-N-[3-(furan-2-ylmethoxy)propyl]piperidine-1-carboxamide is CCOC1CCCN(C(=O)NCCCOCc2ccco2)C1.
What is the InChIKey of 3-ethoxy-N-[3-(furan-2-ylmethoxy)propyl]piperidine-1-carboxamide?
The InChIKey is XIWDRPPRDZSROF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O4/c1-2-21-14-6-3-9-18(12-14)16(19)17-8-5-10-20-13-15-7-4-11-22-15/h4,7,11,14H,2-3,5-6,8-10,12-13H2,1H3,(H,17,19).
What are the key properties of 3-ethoxy-N-[3-(furan-2-ylmethoxy)propyl]piperidine-1-carboxamide?
3-ethoxy-N-[3-(furan-2-ylmethoxy)propyl]piperidine-1-carboxamide has a molecular weight of 310.39 g/mol, XLogP of 2.40, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-N-[3-(furan-2-ylmethoxy)propyl]piperidine-1-carboxamide is sourced from PubChem (CID 86843944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).