1-(2-ethylfuran-3-carbonyl)-3-hydroxypiperidine-3-carboxamide

C13H18N2O4 — CID 128964618

IUPAC1-(2-ethylfuran-3-carbonyl)-3-hydroxypiperidine-3-carboxamide
SMILESCCc1occc1C(=O)N1CCCC(O)(C(N)=O)C1
InChIInChI=1S/C13H18N2O4/c1-2-10-9(4-7-19-10)11(16)15-6-3-5-13(18,8-15)12(14)17/h4,7,18H,2-3,5-6,8H2,1H3,(H2,14,17)
InChIKeyKCWXEWXRQYKYHV-UHFFFAOYSA-N
MW266.30 g/mol
LogP0.29
Rot. Bonds3

About 1-(2-ethylfuran-3-carbonyl)-3-hydroxypiperidine-3-carboxamide

1-(2-ethylfuran-3-carbonyl)-3-hydroxypiperidine-3-carboxamide (PubChem CID 128964618) has the molecular formula C13H18N2O4 and a molecular weight of 266.30 g/mol. Its IUPAC name is 1-(2-ethylfuran-3-carbonyl)-3-hydroxypiperidine-3-carboxamide.

Molecular Properties

Compound Name1-(2-ethylfuran-3-carbonyl)-3-hydroxypiperidine-3-carboxamide
PubChem CID128964618
Molecular FormulaC13H18N2O4
Molecular Weight266.30 g/mol
Exact Mass266.13
IUPAC Name1-(2-ethylfuran-3-carbonyl)-3-hydroxypiperidine-3-carboxamide
SMILESCCc1occc1C(=O)N1CCCC(O)(C(N)=O)C1
InChIInChI=1S/C13H18N2O4/c1-2-10-9(4-7-19-10)11(16)15-6-3-5-13(18,8-15)12(14)17/h4,7,18H,2-3,5-6,8H2,1H3,(H2,14,17)
InChIKeyKCWXEWXRQYKYHV-UHFFFAOYSA-N
XLogP0.29
TPSA96.77 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 50.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-hydroxy-1-(2-propan-2-ylfuran-3-carbonyl)piperidine-3-carboxamide
CID 128988923
3-hydroxy-1-(5-methylfuran-3-carbonyl)piperidine-3-carboxamide
CID 128964564
1-(4-chloro-2-methylbenzoyl)-3-hydroxypiperidine-3-carboxamide
CID 128964687
(3S)-1-(2-bromo-4-methylbenzoyl)-3-hydroxypiperidine-3-carboxamide
CID 129353762
1-(4-chloro-2-ethoxybenzoyl)-3-hydroxypiperidine-3-carboxamide
CID 128988899
(3R)-1-(2-chloro-4,5-dimethylbenzoyl)-3-hydroxypiperidine-3-carboxamide
CID 129491751
(3S)-1-(3-chloropyridine-4-carbonyl)-3-hydroxypiperidine-3-carboxamide
CID 129485786
1-(3-chloropyridine-4-carbonyl)-3-hydroxypiperidine-3-carboxamide
CID 128964613
(3S)-1-(4-chloro-2-methoxybenzoyl)-3-hydroxypiperidine-3-carboxamide
CID 129485552
(2-ethylfuran-3-yl)-(4-hydroxyiminopiperidin-1-yl)methanone
CID 114103087
(3R)-3-hydroxy-1-(2-phenoxybenzoyl)piperidine-3-carboxamide
CID 129485563
(3S)-3-hydroxy-1-(4-phenylbenzoyl)piperidine-3-carboxamide
CID 100651742

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethylfuran-3-carbonyl)-3-hydroxypiperidine-3-carboxamide?
The IUPAC name of 1-(2-ethylfuran-3-carbonyl)-3-hydroxypiperidine-3-carboxamide (CID 128964618) is 1-(2-ethylfuran-3-carbonyl)-3-hydroxypiperidine-3-carboxamide.
What is the SMILES notation for 1-(2-ethylfuran-3-carbonyl)-3-hydroxypiperidine-3-carboxamide?
The canonical SMILES for 1-(2-ethylfuran-3-carbonyl)-3-hydroxypiperidine-3-carboxamide is CCc1occc1C(=O)N1CCCC(O)(C(N)=O)C1.
What is the InChIKey of 1-(2-ethylfuran-3-carbonyl)-3-hydroxypiperidine-3-carboxamide?
The InChIKey is KCWXEWXRQYKYHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O4/c1-2-10-9(4-7-19-10)11(16)15-6-3-5-13(18,8-15)12(14)17/h4,7,18H,2-3,5-6,8H2,1H3,(H2,14,17).
What are the key properties of 1-(2-ethylfuran-3-carbonyl)-3-hydroxypiperidine-3-carboxamide?
1-(2-ethylfuran-3-carbonyl)-3-hydroxypiperidine-3-carboxamide has a molecular weight of 266.30 g/mol, XLogP of 0.29, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethylfuran-3-carbonyl)-3-hydroxypiperidine-3-carboxamide is sourced from PubChem (CID 128964618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).