3-hydroxy-1-(2-propan-2-ylfuran-3-carbonyl)piperidine-3-carboxamide

C14H20N2O4 — CID 128988923

IUPAC3-hydroxy-1-(2-propan-2-ylfuran-3-carbonyl)piperidine-3-carboxamide
SMILESCC(C)c1occc1C(=O)N1CCCC(O)(C(N)=O)C1
InChIInChI=1S/C14H20N2O4/c1-9(2)11-10(4-7-20-11)12(17)16-6-3-5-14(19,8-16)13(15)18/h4,7,9,19H,3,5-6,8H2,1-2H3,(H2,15,18)
InChIKeyJHMJZRUFUUYFFF-UHFFFAOYSA-N
MW280.32 g/mol
LogP0.86
Rot. Bonds3

About 3-hydroxy-1-(2-propan-2-ylfuran-3-carbonyl)piperidine-3-carboxamide

3-hydroxy-1-(2-propan-2-ylfuran-3-carbonyl)piperidine-3-carboxamide (PubChem CID 128988923) has the molecular formula C14H20N2O4 and a molecular weight of 280.32 g/mol. Its IUPAC name is 3-hydroxy-1-(2-propan-2-ylfuran-3-carbonyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name3-hydroxy-1-(2-propan-2-ylfuran-3-carbonyl)piperidine-3-carboxamide
PubChem CID128988923
Molecular FormulaC14H20N2O4
Molecular Weight280.32 g/mol
Exact Mass280.14
IUPAC Name3-hydroxy-1-(2-propan-2-ylfuran-3-carbonyl)piperidine-3-carboxamide
SMILESCC(C)c1occc1C(=O)N1CCCC(O)(C(N)=O)C1
InChIInChI=1S/C14H20N2O4/c1-9(2)11-10(4-7-20-11)12(17)16-6-3-5-14(19,8-16)13(15)18/h4,7,9,19H,3,5-6,8H2,1-2H3,(H2,15,18)
InChIKeyJHMJZRUFUUYFFF-UHFFFAOYSA-N
XLogP0.86
TPSA96.77 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.32
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-ethylfuran-3-carbonyl)-3-hydroxypiperidine-3-carboxamide
CID 128964618
3-hydroxy-1-(5-methylfuran-3-carbonyl)piperidine-3-carboxamide
CID 128964564
(3S)-1-(2-bromo-4-methylbenzoyl)-3-hydroxypiperidine-3-carboxamide
CID 129353762
1-(4-chloro-2-methylbenzoyl)-3-hydroxypiperidine-3-carboxamide
CID 128964687
(3R)-1-(2-chloro-4,5-dimethylbenzoyl)-3-hydroxypiperidine-3-carboxamide
CID 129491751
1-(4-chloro-3-methylbenzoyl)-3-hydroxypiperidine-3-carboxamide
CID 128964411
1-(3-chloropyridine-4-carbonyl)-3-hydroxypiperidine-3-carboxamide
CID 128964613
(3S)-1-(3-chloropyridine-4-carbonyl)-3-hydroxypiperidine-3-carboxamide
CID 129485786
(3S)-1-(4-chloro-2-methoxybenzoyl)-3-hydroxypiperidine-3-carboxamide
CID 129485552
(3R)-3-hydroxy-1-(2-phenoxybenzoyl)piperidine-3-carboxamide
CID 129485563
(3S)-3-hydroxy-1-(4-phenylbenzoyl)piperidine-3-carboxamide
CID 100651742
1-(4-chloro-2-ethoxybenzoyl)-3-hydroxypiperidine-3-carboxamide
CID 128988899

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-1-(2-propan-2-ylfuran-3-carbonyl)piperidine-3-carboxamide?
The IUPAC name of 3-hydroxy-1-(2-propan-2-ylfuran-3-carbonyl)piperidine-3-carboxamide (CID 128988923) is 3-hydroxy-1-(2-propan-2-ylfuran-3-carbonyl)piperidine-3-carboxamide.
What is the SMILES notation for 3-hydroxy-1-(2-propan-2-ylfuran-3-carbonyl)piperidine-3-carboxamide?
The canonical SMILES for 3-hydroxy-1-(2-propan-2-ylfuran-3-carbonyl)piperidine-3-carboxamide is CC(C)c1occc1C(=O)N1CCCC(O)(C(N)=O)C1.
What is the InChIKey of 3-hydroxy-1-(2-propan-2-ylfuran-3-carbonyl)piperidine-3-carboxamide?
The InChIKey is JHMJZRUFUUYFFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O4/c1-9(2)11-10(4-7-20-11)12(17)16-6-3-5-14(19,8-16)13(15)18/h4,7,9,19H,3,5-6,8H2,1-2H3,(H2,15,18).
What are the key properties of 3-hydroxy-1-(2-propan-2-ylfuran-3-carbonyl)piperidine-3-carboxamide?
3-hydroxy-1-(2-propan-2-ylfuran-3-carbonyl)piperidine-3-carboxamide has a molecular weight of 280.32 g/mol, XLogP of 0.86, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-1-(2-propan-2-ylfuran-3-carbonyl)piperidine-3-carboxamide is sourced from PubChem (CID 128988923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).