[5-(furan-2-yl)furan-2-yl]-(2-methylpiperidin-1-yl)methanone

C15H17NO3 — CID 71690133

IUPAC[5-(furan-2-yl)furan-2-yl]-(2-methylpiperidin-1-yl)methanone
SMILESCC1CCCCN1C(=O)c1ccc(-c2ccco2)o1
InChIInChI=1S/C15H17NO3/c1-11-5-2-3-9-16(11)15(17)14-8-7-13(19-14)12-6-4-10-18-12/h4,6-8,10-11H,2-3,5,9H2,1H3
InChIKeyUUUXKEVTCCXUCY-UHFFFAOYSA-N
MW259.31 g/mol
LogP3.55
Rot. Bonds2

About [5-(furan-2-yl)furan-2-yl]-(2-methylpiperidin-1-yl)methanone

[5-(furan-2-yl)furan-2-yl]-(2-methylpiperidin-1-yl)methanone (PubChem CID 71690133) has the molecular formula C15H17NO3 and a molecular weight of 259.31 g/mol. Its IUPAC name is [5-(furan-2-yl)furan-2-yl]-(2-methylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name[5-(furan-2-yl)furan-2-yl]-(2-methylpiperidin-1-yl)methanone
PubChem CID71690133
Molecular FormulaC15H17NO3
Molecular Weight259.31 g/mol
Exact Mass259.12
IUPAC Name[5-(furan-2-yl)furan-2-yl]-(2-methylpiperidin-1-yl)methanone
SMILESCC1CCCCN1C(=O)c1ccc(-c2ccco2)o1
InChIInChI=1S/C15H17NO3/c1-11-5-2-3-9-16(11)15(17)14-8-7-13(19-14)12-6-4-10-18-12/h4,6-8,10-11H,2-3,5,9H2,1H3
InChIKeyUUUXKEVTCCXUCY-UHFFFAOYSA-N
XLogP3.55
TPSA46.59 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(5-iodofuran-2-yl)-[(2R)-2-methylpiperidin-1-yl]methanone
CID 2129746
[5-(4-fluorophenyl)furan-2-yl]-(2-methylpiperidin-1-yl)methanone
CID 24537508
[5-(4-chlorophenyl)furan-2-yl]-(2-methylpiperidin-1-yl)methanone
CID 18106367
[2-(furan-2-yl)phenyl]-(2-methylpiperidin-1-yl)methanone
CID 168525088
[(2R)-2-methylpiperidin-1-yl]-(5-nitrofuran-2-yl)methanone
CID 755150
[5-(4-chloro-2-methylphenyl)furan-2-yl]-[(2R)-2-methylpiperidin-1-yl]methanone
CID 94076411
[5-(furan-2-yl)-2-methyl-1,1-dioxo-1,2,6-thiadiazin-3-yl]-(2-methylpiperidin-1-yl)methanone
CID 22515295
[6-(furan-2-yl)-1,3-dimethylpyrazolo[5,4-b]pyridin-4-yl]-[(2S)-2-methylpiperidin-1-yl]methanone
CID 51854336
2-(4-methoxyphenyl)-1-[(2R)-2-methylpiperidin-1-yl]ethanone
CID 176781017
N-[2-[(2S)-2-methylpiperidine-1-carbonyl]phenyl]furan-2-carboxamide
CID 849804
(2-hydroxyphenyl)-(2-methylpiperidin-1-yl)methanone
CID 43186537
1-[5-[5-(furan-2-yl)furan-2-yl]furan-2-yl]-2-(4-methylpiperazin-1-yl)ethanone
CID 170861100

Frequently Asked Questions

What is the IUPAC name of [5-(furan-2-yl)furan-2-yl]-(2-methylpiperidin-1-yl)methanone?
The IUPAC name of [5-(furan-2-yl)furan-2-yl]-(2-methylpiperidin-1-yl)methanone (CID 71690133) is [5-(furan-2-yl)furan-2-yl]-(2-methylpiperidin-1-yl)methanone.
What is the SMILES notation for [5-(furan-2-yl)furan-2-yl]-(2-methylpiperidin-1-yl)methanone?
The canonical SMILES for [5-(furan-2-yl)furan-2-yl]-(2-methylpiperidin-1-yl)methanone is CC1CCCCN1C(=O)c1ccc(-c2ccco2)o1.
What is the InChIKey of [5-(furan-2-yl)furan-2-yl]-(2-methylpiperidin-1-yl)methanone?
The InChIKey is UUUXKEVTCCXUCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO3/c1-11-5-2-3-9-16(11)15(17)14-8-7-13(19-14)12-6-4-10-18-12/h4,6-8,10-11H,2-3,5,9H2,1H3.
What are the key properties of [5-(furan-2-yl)furan-2-yl]-(2-methylpiperidin-1-yl)methanone?
[5-(furan-2-yl)furan-2-yl]-(2-methylpiperidin-1-yl)methanone has a molecular weight of 259.31 g/mol, XLogP of 3.55, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(furan-2-yl)furan-2-yl]-(2-methylpiperidin-1-yl)methanone is sourced from PubChem (CID 71690133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).