N-(3,4-dichlorophenyl)-1-(furan-3-carbonyl)piperidine-3-carboxamide

C17H16Cl2N2O3 — CID 46568104

IUPACN-(3,4-dichlorophenyl)-1-(furan-3-carbonyl)piperidine-3-carboxamide
SMILESO=C(Nc1ccc(Cl)c(Cl)c1)C1CCCN(C(=O)c2ccoc2)C1
InChIInChI=1S/C17H16Cl2N2O3/c18-14-4-3-13(8-15(14)19)20-16(22)11-2-1-6-21(9-11)17(23)12-5-7-24-10-12/h3-5,7-8,10-11H,1-2,6,9H2,(H,20,22)
InChIKeyQDGYUYPOWIYPFB-UHFFFAOYSA-N
MW367.23 g/mol
LogP4.08
Rot. Bonds3

About N-(3,4-dichlorophenyl)-1-(furan-3-carbonyl)piperidine-3-carboxamide

N-(3,4-dichlorophenyl)-1-(furan-3-carbonyl)piperidine-3-carboxamide (PubChem CID 46568104) has the molecular formula C17H16Cl2N2O3 and a molecular weight of 367.23 g/mol. Its IUPAC name is N-(3,4-dichlorophenyl)-1-(furan-3-carbonyl)piperidine-3-carboxamide.

Molecular Properties

Compound NameN-(3,4-dichlorophenyl)-1-(furan-3-carbonyl)piperidine-3-carboxamide
PubChem CID46568104
Molecular FormulaC17H16Cl2N2O3
Molecular Weight367.23 g/mol
Exact Mass366.05
IUPAC NameN-(3,4-dichlorophenyl)-1-(furan-3-carbonyl)piperidine-3-carboxamide
SMILESO=C(Nc1ccc(Cl)c(Cl)c1)C1CCCN(C(=O)c2ccoc2)C1
InChIInChI=1S/C17H16Cl2N2O3/c18-14-4-3-13(8-15(14)19)20-16(22)11-2-1-6-21(9-11)17(23)12-5-7-24-10-12/h3-5,7-8,10-11H,1-2,6,9H2,(H,20,22)
InChIKeyQDGYUYPOWIYPFB-UHFFFAOYSA-N
XLogP4.08
TPSA62.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.23
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-chloro-4-fluorophenyl)-1-(furan-3-carbonyl)piperidine-3-carboxamide
CID 42948189
N-(3,5-dichlorophenyl)-1-(furan-3-carbonyl)piperidine-3-carboxamide
CID 42948171
methyl 4-[[1-(furan-3-carbonyl)piperidine-3-carbonyl]amino]benzoate
CID 46568061
N-(6-chloro-1,3-benzothiazol-2-yl)-1-(furan-3-carbonyl)piperidine-3-carboxamide
CID 43054844
(3S)-N-(3,4-dichlorophenyl)-1-methylpiperidine-3-carboxamide
CID 96596420
N-[2-[(2,6-dichlorophenyl)methyl]pyrazol-3-yl]-1-(furan-3-carbonyl)piperidine-3-carboxamide
CID 46451461
N-(3,4-dichlorophenyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 42946658
(3S)-3-N-(3,4-dichlorophenyl)-1-N-propan-2-ylpiperidine-1,3-dicarboxamide
CID 51941064
(3R)-3-N-(3,4-dichlorophenyl)-1-N,1-N-dimethylpiperidine-1,3-dicarboxamide
CID 94161112
ethyl 3-[[1-(furan-3-carbonyl)piperidine-3-carbonyl]amino]benzoate
CID 46604295
1-(furan-3-carbonyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide
CID 46577074
N-[2-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]-1-(furan-3-carbonyl)piperidine-3-carboxamide
CID 46568216

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dichlorophenyl)-1-(furan-3-carbonyl)piperidine-3-carboxamide?
The IUPAC name of N-(3,4-dichlorophenyl)-1-(furan-3-carbonyl)piperidine-3-carboxamide (CID 46568104) is N-(3,4-dichlorophenyl)-1-(furan-3-carbonyl)piperidine-3-carboxamide.
What is the SMILES notation for N-(3,4-dichlorophenyl)-1-(furan-3-carbonyl)piperidine-3-carboxamide?
The canonical SMILES for N-(3,4-dichlorophenyl)-1-(furan-3-carbonyl)piperidine-3-carboxamide is O=C(Nc1ccc(Cl)c(Cl)c1)C1CCCN(C(=O)c2ccoc2)C1.
What is the InChIKey of N-(3,4-dichlorophenyl)-1-(furan-3-carbonyl)piperidine-3-carboxamide?
The InChIKey is QDGYUYPOWIYPFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16Cl2N2O3/c18-14-4-3-13(8-15(14)19)20-16(22)11-2-1-6-21(9-11)17(23)12-5-7-24-10-12/h3-5,7-8,10-11H,1-2,6,9H2,(H,20,22).
What are the key properties of N-(3,4-dichlorophenyl)-1-(furan-3-carbonyl)piperidine-3-carboxamide?
N-(3,4-dichlorophenyl)-1-(furan-3-carbonyl)piperidine-3-carboxamide has a molecular weight of 367.23 g/mol, XLogP of 4.08, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dichlorophenyl)-1-(furan-3-carbonyl)piperidine-3-carboxamide is sourced from PubChem (CID 46568104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).