N-(furan-2-ylmethyl)-4-oxo-4-piperidin-1-ylbutanamide

C14H20N2O3 — CID 865161

IUPACN-(furan-2-ylmethyl)-4-oxo-4-piperidin-1-ylbutanamide
SMILESO=C(CCC(=O)N1CCCCC1)NCc1ccco1
InChIInChI=1S/C14H20N2O3/c17-13(15-11-12-5-4-10-19-12)6-7-14(18)16-8-2-1-3-9-16/h4-5,10H,1-3,6-9,11H2,(H,15,17)
InChIKeyCMSPTPUBQAORFN-UHFFFAOYSA-N
MW264.32 g/mol
LogP1.69
Rot. Bonds5

About N-(furan-2-ylmethyl)-4-oxo-4-piperidin-1-ylbutanamide

N-(furan-2-ylmethyl)-4-oxo-4-piperidin-1-ylbutanamide (PubChem CID 865161) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-4-oxo-4-piperidin-1-ylbutanamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-4-oxo-4-piperidin-1-ylbutanamide
PubChem CID865161
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC NameN-(furan-2-ylmethyl)-4-oxo-4-piperidin-1-ylbutanamide
SMILESO=C(CCC(=O)N1CCCCC1)NCc1ccco1
InChIInChI=1S/C14H20N2O3/c17-13(15-11-12-5-4-10-19-12)6-7-14(18)16-8-2-1-3-9-16/h4-5,10H,1-3,6-9,11H2,(H,15,17)
InChIKeyCMSPTPUBQAORFN-UHFFFAOYSA-N
XLogP1.69
TPSA62.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(azepan-1-yl)-N-(furan-2-ylmethyl)-3-oxopropanamide
CID 108945088
3-(azepan-1-yl)-N-(furan-2-ylmethyl)propanamide
CID 109018473
N-(furan-2-ylmethyl)-3-piperidin-1-ylpropanamide
CID 110688280
1-(azepan-1-yl)-3-(furan-2-ylmethylamino)propan-1-one
CID 109018638
N-(furan-2-ylmethyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]-4-oxobutanamide
CID 3980124
4-[(2S)-2-formylpyrrolidin-1-yl]-N-(furan-2-ylmethyl)-4-oxobutanamide
CID 14674759
(3R)-N-(furan-2-ylmethyl)-3-hydroxy-4-oxo-4-pyrrolidin-1-ylbutanamide
CID 70330321
N-(furan-2-ylmethyl)-4-oxo-4-[4-([1,3]thiazolo[5,4-b]pyridin-2-yl)-1,4-diazepan-1-yl]butanamide
CID 53111702
N-(furan-2-ylmethyl)-5-piperidin-1-ylsulfonylpentanamide
CID 110299780
4-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(furan-2-ylmethyl)-4-oxobutanamide
CID 27650062
N-(furan-2-ylmethyl)-2-pyrrolidin-1-yl-2-sulfanylideneacetamide
CID 2975846
N-(furan-2-ylmethyl)-2,2-dimethyl-3-oxo-3-piperidin-1-ylpropanamide
CID 108958739

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-4-oxo-4-piperidin-1-ylbutanamide?
The IUPAC name of N-(furan-2-ylmethyl)-4-oxo-4-piperidin-1-ylbutanamide (CID 865161) is N-(furan-2-ylmethyl)-4-oxo-4-piperidin-1-ylbutanamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-4-oxo-4-piperidin-1-ylbutanamide?
The canonical SMILES for N-(furan-2-ylmethyl)-4-oxo-4-piperidin-1-ylbutanamide is O=C(CCC(=O)N1CCCCC1)NCc1ccco1.
What is the InChIKey of N-(furan-2-ylmethyl)-4-oxo-4-piperidin-1-ylbutanamide?
The InChIKey is CMSPTPUBQAORFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c17-13(15-11-12-5-4-10-19-12)6-7-14(18)16-8-2-1-3-9-16/h4-5,10H,1-3,6-9,11H2,(H,15,17).
What are the key properties of N-(furan-2-ylmethyl)-4-oxo-4-piperidin-1-ylbutanamide?
N-(furan-2-ylmethyl)-4-oxo-4-piperidin-1-ylbutanamide has a molecular weight of 264.32 g/mol, XLogP of 1.69, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-4-oxo-4-piperidin-1-ylbutanamide is sourced from PubChem (CID 865161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).