N-(4-oxocyclohexyl)furan-3-carboxamide

C11H13NO3 — CID 43652764

IUPACN-(4-oxocyclohexyl)furan-3-carboxamide
SMILESO=C1CCC(NC(=O)c2ccoc2)CC1
InChIInChI=1S/C11H13NO3/c13-10-3-1-9(2-4-10)12-11(14)8-5-6-15-7-8/h5-7,9H,1-4H2,(H,12,14)
InChIKeyDUPFOZPUMQKDJK-UHFFFAOYSA-N
MW207.23 g/mol
LogP1.52
Rot. Bonds2

About N-(4-oxocyclohexyl)furan-3-carboxamide

N-(4-oxocyclohexyl)furan-3-carboxamide (PubChem CID 43652764) has the molecular formula C11H13NO3 and a molecular weight of 207.23 g/mol. Its IUPAC name is N-(4-oxocyclohexyl)furan-3-carboxamide.

Molecular Properties

Compound NameN-(4-oxocyclohexyl)furan-3-carboxamide
PubChem CID43652764
Molecular FormulaC11H13NO3
Molecular Weight207.23 g/mol
Exact Mass207.09
IUPAC NameN-(4-oxocyclohexyl)furan-3-carboxamide
SMILESO=C1CCC(NC(=O)c2ccoc2)CC1
InChIInChI=1S/C11H13NO3/c13-10-3-1-9(2-4-10)12-11(14)8-5-6-15-7-8/h5-7,9H,1-4H2,(H,12,14)
InChIKeyDUPFOZPUMQKDJK-UHFFFAOYSA-N
XLogP1.52
TPSA59.31 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.23
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropylfuran-3-carboxamide
CID 60698418
N-(oxolan-3-yl)furan-3-carboxamide
CID 130743970
N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)furan-3-carboxamide
CID 86771954
N-[1-[(2R)-1-amino-1-oxopropan-2-yl]piperidin-4-yl]furan-3-carboxamide
CID 94200129
N-[1-[(1R,6S)-bicyclo[4.1.0]heptane-7-carbonyl]piperidin-4-yl]furan-3-carboxamide
CID 95905163
N-[1-(3-methylbutanoyl)piperidin-4-yl]furan-3-carboxamide
CID 47073768
N-[(2R)-1-(cyclooctylamino)-1-oxopropan-2-yl]furan-3-carboxamide
CID 94170401
4-tert-butyl-N-(4-oxocyclohexyl)benzamide
CID 43652861
N-[1-[(1S)-2-amino-2-oxo-1-phenylethyl]piperidin-4-yl]furan-3-carboxamide
CID 95584264
N-[1-[6-(4-methylpiperazin-1-yl)pyridazin-3-yl]piperidin-4-yl]furan-3-carboxamide
CID 50845882
2-(furan-3-carbonylamino)cyclohexane-1-carboxylic acid
CID 64812899
N-[1-[(2-methylphenyl)methyl]piperidin-4-yl]furan-3-carboxamide
CID 136577828

Frequently Asked Questions

What is the IUPAC name of N-(4-oxocyclohexyl)furan-3-carboxamide?
The IUPAC name of N-(4-oxocyclohexyl)furan-3-carboxamide (CID 43652764) is N-(4-oxocyclohexyl)furan-3-carboxamide.
What is the SMILES notation for N-(4-oxocyclohexyl)furan-3-carboxamide?
The canonical SMILES for N-(4-oxocyclohexyl)furan-3-carboxamide is O=C1CCC(NC(=O)c2ccoc2)CC1.
What is the InChIKey of N-(4-oxocyclohexyl)furan-3-carboxamide?
The InChIKey is DUPFOZPUMQKDJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO3/c13-10-3-1-9(2-4-10)12-11(14)8-5-6-15-7-8/h5-7,9H,1-4H2,(H,12,14).
What are the key properties of N-(4-oxocyclohexyl)furan-3-carboxamide?
N-(4-oxocyclohexyl)furan-3-carboxamide has a molecular weight of 207.23 g/mol, XLogP of 1.52, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-oxocyclohexyl)furan-3-carboxamide is sourced from PubChem (CID 43652764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).