furan-2-yl-[4-(2-pyridin-2-ylimidazol-1-yl)piperidin-1-yl]methanone

C18H18N4O2 — CID 56714544

IUPACfuran-2-yl-[4-(2-pyridin-2-ylimidazol-1-yl)piperidin-1-yl]methanone
SMILESO=C(c1ccco1)N1CCC(n2ccnc2-c2ccccn2)CC1
InChIInChI=1S/C18H18N4O2/c23-18(16-5-3-13-24-16)21-10-6-14(7-11-21)22-12-9-20-17(22)15-4-1-2-8-19-15/h1-5,8-9,12-14H,6-7,10-11H2
InChIKeyLFVZSWNUBIOBJQ-UHFFFAOYSA-N
MW322.37 g/mol
LogP3.02
Rot. Bonds3

About furan-2-yl-[4-(2-pyridin-2-ylimidazol-1-yl)piperidin-1-yl]methanone

furan-2-yl-[4-(2-pyridin-2-ylimidazol-1-yl)piperidin-1-yl]methanone (PubChem CID 56714544) has the molecular formula C18H18N4O2 and a molecular weight of 322.37 g/mol. Its IUPAC name is furan-2-yl-[4-(2-pyridin-2-ylimidazol-1-yl)piperidin-1-yl]methanone.

Molecular Properties

Compound Namefuran-2-yl-[4-(2-pyridin-2-ylimidazol-1-yl)piperidin-1-yl]methanone
PubChem CID56714544
Molecular FormulaC18H18N4O2
Molecular Weight322.37 g/mol
Exact Mass322.14
IUPAC Namefuran-2-yl-[4-(2-pyridin-2-ylimidazol-1-yl)piperidin-1-yl]methanone
SMILESO=C(c1ccco1)N1CCC(n2ccnc2-c2ccccn2)CC1
InChIInChI=1S/C18H18N4O2/c23-18(16-5-3-13-24-16)21-10-6-14(7-11-21)22-12-9-20-17(22)15-4-1-2-8-19-15/h1-5,8-9,12-14H,6-7,10-11H2
InChIKeyLFVZSWNUBIOBJQ-UHFFFAOYSA-N
XLogP3.02
TPSA64.16 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.37
LogP ≤ 53.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

Noberastine
CID 60531
N-[3-(1-ethyl-1H-benzimidazol-2-yl)propyl]furan-2-carboxamide
CID 3164555
[3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-4H-imidazo[1,5-a]quinoxalin-5-yl]-(furan-2-yl)methanone
CID 10833139
Barmastine
CID 71300
Triazine-4-carboxamide, 10
CID 44520935
Triazine-4-carboxamide, 13
CID 44520938
Pyrimidine-4-carboxamide, 119
CID 44520983
Pyrimidine-4-carboxamide, 120
CID 44520984
Pyrimidine-4-carboxamide, 121
CID 44520985
N-[2-(1-propylbenzimidazol-2-yl)ethyl]furan-2-carboxamide
CID 3164519
N-[2-[1-(2-methylprop-2-enyl)benzimidazol-2-yl]ethyl]furan-2-carboxamide
CID 3164520
N-[6-(pentanoylamino)pyridin-3-yl]furan-2-carboxamide
CID 3213149

Frequently Asked Questions

What is the IUPAC name of furan-2-yl-[4-(2-pyridin-2-ylimidazol-1-yl)piperidin-1-yl]methanone?
The IUPAC name of furan-2-yl-[4-(2-pyridin-2-ylimidazol-1-yl)piperidin-1-yl]methanone (CID 56714544) is furan-2-yl-[4-(2-pyridin-2-ylimidazol-1-yl)piperidin-1-yl]methanone.
What is the SMILES notation for furan-2-yl-[4-(2-pyridin-2-ylimidazol-1-yl)piperidin-1-yl]methanone?
The canonical SMILES for furan-2-yl-[4-(2-pyridin-2-ylimidazol-1-yl)piperidin-1-yl]methanone is O=C(c1ccco1)N1CCC(n2ccnc2-c2ccccn2)CC1.
What is the InChIKey of furan-2-yl-[4-(2-pyridin-2-ylimidazol-1-yl)piperidin-1-yl]methanone?
The InChIKey is LFVZSWNUBIOBJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O2/c23-18(16-5-3-13-24-16)21-10-6-14(7-11-21)22-12-9-20-17(22)15-4-1-2-8-19-15/h1-5,8-9,12-14H,6-7,10-11H2.
What are the key properties of furan-2-yl-[4-(2-pyridin-2-ylimidazol-1-yl)piperidin-1-yl]methanone?
furan-2-yl-[4-(2-pyridin-2-ylimidazol-1-yl)piperidin-1-yl]methanone has a molecular weight of 322.37 g/mol, XLogP of 3.02, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for furan-2-yl-[4-(2-pyridin-2-ylimidazol-1-yl)piperidin-1-yl]methanone is sourced from PubChem (CID 56714544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).