1-(furan-3-carbonyl)-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]piperidine-3-carboxamide

C20H26N4O4 — CID 46568205

IUPAC1-(furan-3-carbonyl)-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]piperidine-3-carboxamide
SMILESCc1nc(C2(NC(=O)C3CCCN(C(=O)c4ccoc4)C3)CCCCC2)no1
InChIInChI=1S/C20H26N4O4/c1-14-21-19(23-28-14)20(8-3-2-4-9-20)22-17(25)15-6-5-10-24(12-15)18(26)16-7-11-27-13-16/h7,11,13,15H,2-6,8-10,12H2,1H3,(H,22,25)
InChIKeyVJEQNJZLQVJHCQ-UHFFFAOYSA-N
MW386.45 g/mol
LogP2.80
Rot. Bonds4

About 1-(furan-3-carbonyl)-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]piperidine-3-carboxamide

1-(furan-3-carbonyl)-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]piperidine-3-carboxamide (PubChem CID 46568205) has the molecular formula C20H26N4O4 and a molecular weight of 386.45 g/mol. Its IUPAC name is 1-(furan-3-carbonyl)-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]piperidine-3-carboxamide.

Molecular Properties

Compound Name1-(furan-3-carbonyl)-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]piperidine-3-carboxamide
PubChem CID46568205
Molecular FormulaC20H26N4O4
Molecular Weight386.45 g/mol
Exact Mass386.20
IUPAC Name1-(furan-3-carbonyl)-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]piperidine-3-carboxamide
SMILESCc1nc(C2(NC(=O)C3CCCN(C(=O)c4ccoc4)C3)CCCCC2)no1
InChIInChI=1S/C20H26N4O4/c1-14-21-19(23-28-14)20(8-3-2-4-9-20)22-17(25)15-6-5-10-24(12-15)18(26)16-7-11-27-13-16/h7,11,13,15H,2-6,8-10,12H2,1H3,(H,22,25)
InChIKeyVJEQNJZLQVJHCQ-UHFFFAOYSA-N
XLogP2.80
TPSA101.47 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.45
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]cyclopentanecarboxamide
CID 35781179
1-(4-fluorophenyl)sulfonyl-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cycloheptyl]piperidine-3-carboxamide
CID 55621991
1-(furan-2-carbonyl)-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]piperidine-4-carboxamide
CID 55528496
N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cycloheptyl]-1-prop-2-enoylpiperidine-4-carboxamide
CID 166411028
(3S)-N-ethyl-1-(furan-3-carbonyl)piperidine-3-carboxamide
CID 30830527
N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cycloheptyl]-1-(2,2,2-trifluoroethyl)piperidine-4-carboxamide
CID 86822640
1-(furan-3-carbonyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide
CID 46577074
methyl (3S)-1-(furan-3-carbonyl)piperidine-3-carboxylate
CID 78919632
furan-3-yl-[(3S)-3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methanone
CID 94207997
N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]pyrrolidine-3-carboxamide
CID 119701778
1-benzylsulfonyl-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cycloheptyl]piperidine-4-carboxamide
CID 55972563
N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]pyrrolidine-3-carboxamide;hydrochloride
CID 119701777

Frequently Asked Questions

What is the IUPAC name of 1-(furan-3-carbonyl)-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]piperidine-3-carboxamide?
The IUPAC name of 1-(furan-3-carbonyl)-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]piperidine-3-carboxamide (CID 46568205) is 1-(furan-3-carbonyl)-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]piperidine-3-carboxamide.
What is the SMILES notation for 1-(furan-3-carbonyl)-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]piperidine-3-carboxamide?
The canonical SMILES for 1-(furan-3-carbonyl)-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]piperidine-3-carboxamide is Cc1nc(C2(NC(=O)C3CCCN(C(=O)c4ccoc4)C3)CCCCC2)no1.
What is the InChIKey of 1-(furan-3-carbonyl)-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]piperidine-3-carboxamide?
The InChIKey is VJEQNJZLQVJHCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N4O4/c1-14-21-19(23-28-14)20(8-3-2-4-9-20)22-17(25)15-6-5-10-24(12-15)18(26)16-7-11-27-13-16/h7,11,13,15H,2-6,8-10,12H2,1H3,(H,22,25).
What are the key properties of 1-(furan-3-carbonyl)-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]piperidine-3-carboxamide?
1-(furan-3-carbonyl)-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]piperidine-3-carboxamide has a molecular weight of 386.45 g/mol, XLogP of 2.80, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-3-carbonyl)-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]piperidine-3-carboxamide is sourced from PubChem (CID 46568205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).