2-[1-(furan-3-carbonyl)piperidin-4-yl]-1-phenyl-2-azaspiro[3.5]nonan-3-one

C24H28N2O3 — CID 146072062

IUPAC2-[1-(furan-3-carbonyl)piperidin-4-yl]-1-phenyl-2-azaspiro[3.5]nonan-3-one
SMILESO=C(c1ccoc1)N1CCC(N2C(=O)C3(CCCCC3)C2c2ccccc2)CC1
InChIInChI=1S/C24H28N2O3/c27-22(19-11-16-29-17-19)25-14-9-20(10-15-25)26-21(18-7-3-1-4-8-18)24(23(26)28)12-5-2-6-13-24/h1,3-4,7-8,11,16-17,20-21H,2,5-6,9-10,12-15H2
InChIKeyZHUZFESJBMYVHW-UHFFFAOYSA-N
MW392.50 g/mol
LogP4.42
Rot. Bonds3

About 2-[1-(furan-3-carbonyl)piperidin-4-yl]-1-phenyl-2-azaspiro[3.5]nonan-3-one

2-[1-(furan-3-carbonyl)piperidin-4-yl]-1-phenyl-2-azaspiro[3.5]nonan-3-one (PubChem CID 146072062) has the molecular formula C24H28N2O3 and a molecular weight of 392.50 g/mol. Its IUPAC name is 2-[1-(furan-3-carbonyl)piperidin-4-yl]-1-phenyl-2-azaspiro[3.5]nonan-3-one.

Molecular Properties

Compound Name2-[1-(furan-3-carbonyl)piperidin-4-yl]-1-phenyl-2-azaspiro[3.5]nonan-3-one
PubChem CID146072062
Molecular FormulaC24H28N2O3
Molecular Weight392.50 g/mol
Exact Mass392.21
IUPAC Name2-[1-(furan-3-carbonyl)piperidin-4-yl]-1-phenyl-2-azaspiro[3.5]nonan-3-one
SMILESO=C(c1ccoc1)N1CCC(N2C(=O)C3(CCCCC3)C2c2ccccc2)CC1
InChIInChI=1S/C24H28N2O3/c27-22(19-11-16-29-17-19)25-14-9-20(10-15-25)26-21(18-7-3-1-4-8-18)24(23(26)28)12-5-2-6-13-24/h1,3-4,7-8,11,16-17,20-21H,2,5-6,9-10,12-15H2
InChIKeyZHUZFESJBMYVHW-UHFFFAOYSA-N
XLogP4.42
TPSA53.76 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.50
LogP ≤ 54.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[1-(1H-imidazole-5-carbonyl)piperidin-4-yl]-1-phenyl-2-azaspiro[3.5]nonan-3-one
CID 146072045
2-[1-[2-(1-methylpiperidin-4-yl)acetyl]piperidin-4-yl]-1-phenyl-2-azaspiro[3.5]nonan-3-one
CID 146072042
2-[1-[2-(1-ethylpiperidin-4-yl)acetyl]piperidin-4-yl]-1-phenyl-2-azaspiro[3.5]nonan-3-one
CID 146072035
2-[1-(6-methoxypyridine-3-carbonyl)piperidin-4-yl]-1-pyridin-4-yl-2-azaspiro[3.5]nonan-3-one
CID 91921151
[4-(2,3-dihydroindol-1-yl)piperidin-1-yl]-(furan-3-yl)methanone
CID 53015005
(3R)-N-benzyl-1-[1-(furan-3-carbonyl)piperidin-4-yl]piperidine-3-carboxamide
CID 26393459
1-(furan-3-carbonyl)-N-[(1-hydroxycyclohexyl)methyl]piperidine-4-carboxamide
CID 111445987
[(3R,4R)-3-(aminomethyl)-4-phenylpyrrolidin-1-yl]-(furan-3-yl)methanone
CID 120745387
[4-[[(S)-cyclobutyl(phenyl)methyl]amino]piperidin-1-yl]-(furan-3-yl)methanone
CID 97081115
furan-3-yl-[4-[(1-hydroxycyclohexyl)methyl]piperazin-1-yl]methanone
CID 110905169
[1-(furan-3-carbonyl)piperidin-4-yl]-(4-phenylpiperazin-1-yl)methanone
CID 35503421
N-[1-(2-chlorophenyl)-2-oxocyclohexyl]-1-(furan-3-carbonyl)-N-methylpiperidine-4-carboxamide
CID 55670626

Frequently Asked Questions

What is the IUPAC name of 2-[1-(furan-3-carbonyl)piperidin-4-yl]-1-phenyl-2-azaspiro[3.5]nonan-3-one?
The IUPAC name of 2-[1-(furan-3-carbonyl)piperidin-4-yl]-1-phenyl-2-azaspiro[3.5]nonan-3-one (CID 146072062) is 2-[1-(furan-3-carbonyl)piperidin-4-yl]-1-phenyl-2-azaspiro[3.5]nonan-3-one.
What is the SMILES notation for 2-[1-(furan-3-carbonyl)piperidin-4-yl]-1-phenyl-2-azaspiro[3.5]nonan-3-one?
The canonical SMILES for 2-[1-(furan-3-carbonyl)piperidin-4-yl]-1-phenyl-2-azaspiro[3.5]nonan-3-one is O=C(c1ccoc1)N1CCC(N2C(=O)C3(CCCCC3)C2c2ccccc2)CC1.
What is the InChIKey of 2-[1-(furan-3-carbonyl)piperidin-4-yl]-1-phenyl-2-azaspiro[3.5]nonan-3-one?
The InChIKey is ZHUZFESJBMYVHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N2O3/c27-22(19-11-16-29-17-19)25-14-9-20(10-15-25)26-21(18-7-3-1-4-8-18)24(23(26)28)12-5-2-6-13-24/h1,3-4,7-8,11,16-17,20-21H,2,5-6,9-10,12-15H2.
What are the key properties of 2-[1-(furan-3-carbonyl)piperidin-4-yl]-1-phenyl-2-azaspiro[3.5]nonan-3-one?
2-[1-(furan-3-carbonyl)piperidin-4-yl]-1-phenyl-2-azaspiro[3.5]nonan-3-one has a molecular weight of 392.50 g/mol, XLogP of 4.42, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(furan-3-carbonyl)piperidin-4-yl]-1-phenyl-2-azaspiro[3.5]nonan-3-one is sourced from PubChem (CID 146072062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).