1-[1-[5-(hydroxymethyl)furan-2-carbonyl]piperidin-4-yl]pyrrolidin-2-one

C15H20N2O4 — CID 56879144

IUPAC1-[1-[5-(hydroxymethyl)furan-2-carbonyl]piperidin-4-yl]pyrrolidin-2-one
SMILESO=C(c1ccc(CO)o1)N1CCC(N2CCCC2=O)CC1
InChIInChI=1S/C15H20N2O4/c18-10-12-3-4-13(21-12)15(20)16-8-5-11(6-9-16)17-7-1-2-14(17)19/h3-4,11,18H,1-2,5-10H2
InChIKeyYVRASGFGBMRILI-UHFFFAOYSA-N
MW292.33 g/mol
LogP1.00
Rot. Bonds3

About 1-[1-[5-(hydroxymethyl)furan-2-carbonyl]piperidin-4-yl]pyrrolidin-2-one

1-[1-[5-(hydroxymethyl)furan-2-carbonyl]piperidin-4-yl]pyrrolidin-2-one (PubChem CID 56879144) has the molecular formula C15H20N2O4 and a molecular weight of 292.33 g/mol. Its IUPAC name is 1-[1-[5-(hydroxymethyl)furan-2-carbonyl]piperidin-4-yl]pyrrolidin-2-one.

Molecular Properties

Compound Name1-[1-[5-(hydroxymethyl)furan-2-carbonyl]piperidin-4-yl]pyrrolidin-2-one
PubChem CID56879144
Molecular FormulaC15H20N2O4
Molecular Weight292.33 g/mol
Exact Mass292.14
IUPAC Name1-[1-[5-(hydroxymethyl)furan-2-carbonyl]piperidin-4-yl]pyrrolidin-2-one
SMILESO=C(c1ccc(CO)o1)N1CCC(N2CCCC2=O)CC1
InChIInChI=1S/C15H20N2O4/c18-10-12-3-4-13(21-12)15(20)16-8-5-11(6-9-16)17-7-1-2-14(17)19/h3-4,11,18H,1-2,5-10H2
InChIKeyYVRASGFGBMRILI-UHFFFAOYSA-N
XLogP1.00
TPSA73.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.33
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-1-[1-[5-(hydroxymethyl)furan-2-carbonyl]piperidin-4-yl]piperidine-3-carboxamide
CID 56879299
(2,5-dihydroxypyrrol-1-yl) 4-(2-oxopyrrolidin-1-yl)piperidine-1-carboxylate
CID 123395480
1-[1-[1-(thiophen-2-ylmethyl)pyrrole-2-carbonyl]piperidin-4-yl]piperidin-2-one
CID 99818850
1-[1-(4H-furo[3,2-b]pyrrole-5-carbonyl)piperidin-4-yl]pyrrolidin-2-one
CID 138996131
4-(2-oxopyrrolidin-1-yl)azepane-1-carboxamide
CID 146082370
1-[1-[4-(pyridin-4-ylmethylamino)benzoyl]piperidin-4-yl]pyrrolidin-2-one
CID 56880689
1-[1-[2-[6-(trifluoromethyl)-3-pyridinyl]acetyl]piperidin-4-yl]piperidin-2-one
CID 166246481
1-[1-(1H-indole-5-carbonyl)piperidin-4-yl]pyrrolidin-2-one
CID 126899305
1-[1-(1H-indole-3-carbonyl)piperidin-4-yl]pyrrolidin-2-one
CID 126855908
(1S,5R)-6-benzyl-3-[5-(hydroxymethyl)furan-2-carbonyl]-3,6-diazabicyclo[3.2.2]nonan-7-one
CID 70759645
1-(5-ethylfuran-2-carbonyl)piperidin-4-one
CID 79095458
2-benzyl-6-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one
CID 86892256

Frequently Asked Questions

What is the IUPAC name of 1-[1-[5-(hydroxymethyl)furan-2-carbonyl]piperidin-4-yl]pyrrolidin-2-one?
The IUPAC name of 1-[1-[5-(hydroxymethyl)furan-2-carbonyl]piperidin-4-yl]pyrrolidin-2-one (CID 56879144) is 1-[1-[5-(hydroxymethyl)furan-2-carbonyl]piperidin-4-yl]pyrrolidin-2-one.
What is the SMILES notation for 1-[1-[5-(hydroxymethyl)furan-2-carbonyl]piperidin-4-yl]pyrrolidin-2-one?
The canonical SMILES for 1-[1-[5-(hydroxymethyl)furan-2-carbonyl]piperidin-4-yl]pyrrolidin-2-one is O=C(c1ccc(CO)o1)N1CCC(N2CCCC2=O)CC1.
What is the InChIKey of 1-[1-[5-(hydroxymethyl)furan-2-carbonyl]piperidin-4-yl]pyrrolidin-2-one?
The InChIKey is YVRASGFGBMRILI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O4/c18-10-12-3-4-13(21-12)15(20)16-8-5-11(6-9-16)17-7-1-2-14(17)19/h3-4,11,18H,1-2,5-10H2.
What are the key properties of 1-[1-[5-(hydroxymethyl)furan-2-carbonyl]piperidin-4-yl]pyrrolidin-2-one?
1-[1-[5-(hydroxymethyl)furan-2-carbonyl]piperidin-4-yl]pyrrolidin-2-one has a molecular weight of 292.33 g/mol, XLogP of 1.00, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[5-(hydroxymethyl)furan-2-carbonyl]piperidin-4-yl]pyrrolidin-2-one is sourced from PubChem (CID 56879144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).