[2-(furan-3-yl)piperidin-1-yl]-phenylmethanone

C16H17NO2 — CID 102544350

IUPAC[2-(furan-3-yl)piperidin-1-yl]-phenylmethanone
SMILESO=C(c1ccccc1)N1CCCCC1c1ccoc1
InChIInChI=1S/C16H17NO2/c18-16(13-6-2-1-3-7-13)17-10-5-4-8-15(17)14-9-11-19-12-14/h1-3,6-7,9,11-12,15H,4-5,8,10H2
InChIKeyRRSMHEXCMOQOLT-UHFFFAOYSA-N
MW255.32 g/mol
LogP3.65
Rot. Bonds2

About [2-(furan-3-yl)piperidin-1-yl]-phenylmethanone

[2-(furan-3-yl)piperidin-1-yl]-phenylmethanone (PubChem CID 102544350) has the molecular formula C16H17NO2 and a molecular weight of 255.32 g/mol. Its IUPAC name is [2-(furan-3-yl)piperidin-1-yl]-phenylmethanone.

Molecular Properties

Compound Name[2-(furan-3-yl)piperidin-1-yl]-phenylmethanone
PubChem CID102544350
Molecular FormulaC16H17NO2
Molecular Weight255.32 g/mol
Exact Mass255.13
IUPAC Name[2-(furan-3-yl)piperidin-1-yl]-phenylmethanone
SMILESO=C(c1ccccc1)N1CCCCC1c1ccoc1
InChIInChI=1S/C16H17NO2/c18-16(13-6-2-1-3-7-13)17-10-5-4-8-15(17)14-9-11-19-12-14/h1-3,6-7,9,11-12,15H,4-5,8,10H2
InChIKeyRRSMHEXCMOQOLT-UHFFFAOYSA-N
XLogP3.65
TPSA33.45 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 53.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(4-aminophenyl)-(2-phenylazepan-1-yl)methanone;hydrochloride
CID 119737788
phenyl-(2-phenylpiperidin-1-yl)methanone;N-propan-2-ylformamide
CID 167491595
(2-hydroxypiperidin-1-yl)-phenylmethanone
CID 14920288
phenyl-(2-thiophen-3-ylpyrrolidin-1-yl)methanone
CID 60770024
furan-3-yl-[2-(4-methoxyphenyl)azepan-1-yl]methanone
CID 51267049
[2-(2-chlorophenyl)pyrrolidin-1-yl]-phenylmethanone
CID 61061635
[(2R)-2-phenylpyrrolidin-1-yl]-(4-pyrrol-1-ylphenyl)methanone
CID 41265479
furan-3-yl-(2-pyridin-4-ylpyrrolidin-1-yl)methanone
CID 24631497
phenyl-[(2R)-2-quinolin-6-ylpiperidin-1-yl]methanone
CID 124501089
[2-[6-(cyclopropylamino)-3-pyridinyl]piperidin-1-yl]-phenylmethanone
CID 102540373
phenyl-[2-(6-sulfanylidene-1H-pyridin-3-yl)pyrrolidin-1-yl]methanone
CID 102542015
[(2R)-2-[2-(methylamino)-4-pyridinyl]pyrrolidin-1-yl]-phenylmethanone
CID 125001597

Frequently Asked Questions

What is the IUPAC name of [2-(furan-3-yl)piperidin-1-yl]-phenylmethanone?
The IUPAC name of [2-(furan-3-yl)piperidin-1-yl]-phenylmethanone (CID 102544350) is [2-(furan-3-yl)piperidin-1-yl]-phenylmethanone.
What is the SMILES notation for [2-(furan-3-yl)piperidin-1-yl]-phenylmethanone?
The canonical SMILES for [2-(furan-3-yl)piperidin-1-yl]-phenylmethanone is O=C(c1ccccc1)N1CCCCC1c1ccoc1.
What is the InChIKey of [2-(furan-3-yl)piperidin-1-yl]-phenylmethanone?
The InChIKey is RRSMHEXCMOQOLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO2/c18-16(13-6-2-1-3-7-13)17-10-5-4-8-15(17)14-9-11-19-12-14/h1-3,6-7,9,11-12,15H,4-5,8,10H2.
What are the key properties of [2-(furan-3-yl)piperidin-1-yl]-phenylmethanone?
[2-(furan-3-yl)piperidin-1-yl]-phenylmethanone has a molecular weight of 255.32 g/mol, XLogP of 3.65, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(furan-3-yl)piperidin-1-yl]-phenylmethanone is sourced from PubChem (CID 102544350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).