furan-3-yl-[(1S,5S)-3-pyridin-3-yloxy-8-azabicyclo[3.2.1]octan-8-yl]methanone

C17H18N2O3 — CID 129357635

IUPACfuran-3-yl-[(1S,5S)-3-pyridin-3-yloxy-8-azabicyclo[3.2.1]octan-8-yl]methanone
SMILESO=C(c1ccoc1)N1[C@H]2CC[C@H]1CC(Oc1cccnc1)C2
InChIInChI=1S/C17H18N2O3/c20-17(12-5-7-21-11-12)19-13-3-4-14(19)9-16(8-13)22-15-2-1-6-18-10-15/h1-2,5-7,10-11,13-14,16H,3-4,8-9H2/t13-,14-/m0/s1
InChIKeyUBUWNHHQKZKTJP-KBPBESRZSA-N
MW298.34 g/mol
LogP2.89
Rot. Bonds3

About furan-3-yl-[(1S,5S)-3-pyridin-3-yloxy-8-azabicyclo[3.2.1]octan-8-yl]methanone

furan-3-yl-[(1S,5S)-3-pyridin-3-yloxy-8-azabicyclo[3.2.1]octan-8-yl]methanone (PubChem CID 129357635) has the molecular formula C17H18N2O3 and a molecular weight of 298.34 g/mol. Its IUPAC name is furan-3-yl-[(1S,5S)-3-pyridin-3-yloxy-8-azabicyclo[3.2.1]octan-8-yl]methanone.

Molecular Properties

Compound Namefuran-3-yl-[(1S,5S)-3-pyridin-3-yloxy-8-azabicyclo[3.2.1]octan-8-yl]methanone
PubChem CID129357635
Molecular FormulaC17H18N2O3
Molecular Weight298.34 g/mol
Exact Mass298.13
IUPAC Namefuran-3-yl-[(1S,5S)-3-pyridin-3-yloxy-8-azabicyclo[3.2.1]octan-8-yl]methanone
SMILESO=C(c1ccoc1)N1[C@H]2CC[C@H]1CC(Oc1cccnc1)C2
InChIInChI=1S/C17H18N2O3/c20-17(12-5-7-21-11-12)19-13-3-4-14(19)9-16(8-13)22-15-2-1-6-18-10-15/h1-2,5-7,10-11,13-14,16H,3-4,8-9H2/t13-,14-/m0/s1
InChIKeyUBUWNHHQKZKTJP-KBPBESRZSA-N
XLogP2.89
TPSA55.57 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.34
LogP ≤ 52.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze furan-3-yl-[(1S,5S)-3-pyridin-3-yloxy-8-azabicyclo[3.2.1]octan-8-yl]methanone with MolForge

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Related Compounds

(4-fluorophenyl)-(3-pyridin-3-yloxy-8-azabicyclo[3.2.1]octan-8-yl)methanone
CID 121185870
(4-bromophenyl)-(3-pyridin-3-yloxy-8-azabicyclo[3.2.1]octan-8-yl)methanone
CID 121186056
[3,5-bis(trifluoromethyl)phenyl]-(3-pyridin-3-yloxy-8-azabicyclo[3.2.1]octan-8-yl)methanone
CID 121186146
pyridin-2-yl-(3-pyridin-3-yloxy-8-azabicyclo[3.2.1]octan-8-yl)methanone
CID 121185862
(6-cyclopentyloxy-3-pyridinyl)-(3-pyridin-3-yloxy-8-azabicyclo[3.2.1]octan-8-yl)methanone
CID 121186120
(5-methylpyrazin-2-yl)-(3-pyridin-3-yloxy-8-azabicyclo[3.2.1]octan-8-yl)methanone
CID 119103729
phenyl (1S,5S)-3-pyridin-3-yloxy-8-azabicyclo[3.2.1]octane-8-carboxylate
CID 129357029
(2S,4S)-N-cyclopropyl-1-(furan-3-carbonyl)-4-pyridin-3-yloxypyrrolidine-2-carboxamide
CID 110198976
(3-pyridin-3-yloxy-8-azabicyclo[3.2.1]octan-8-yl)-[4-(1,3-thiazol-2-yloxy)phenyl]methanone
CID 121186106
1H-indol-3-yl-(3-pyridin-3-yloxy-8-azabicyclo[3.2.1]octan-8-yl)methanone
CID 121186064
[(2S,4S)-1-(furan-3-carbonyl)-4-pyridin-3-yloxypyrrolidin-2-yl]-pyrrolidin-1-ylmethanone
CID 110198873
N-(oxan-4-yl)-3-pyridin-3-yloxy-8-azabicyclo[3.2.1]octane-8-carboxamide
CID 121186213

Frequently Asked Questions

What is the IUPAC name of furan-3-yl-[(1S,5S)-3-pyridin-3-yloxy-8-azabicyclo[3.2.1]octan-8-yl]methanone?
The IUPAC name of furan-3-yl-[(1S,5S)-3-pyridin-3-yloxy-8-azabicyclo[3.2.1]octan-8-yl]methanone (CID 129357635) is furan-3-yl-[(1S,5S)-3-pyridin-3-yloxy-8-azabicyclo[3.2.1]octan-8-yl]methanone.
What is the SMILES notation for furan-3-yl-[(1S,5S)-3-pyridin-3-yloxy-8-azabicyclo[3.2.1]octan-8-yl]methanone?
The canonical SMILES for furan-3-yl-[(1S,5S)-3-pyridin-3-yloxy-8-azabicyclo[3.2.1]octan-8-yl]methanone is O=C(c1ccoc1)N1[C@H]2CC[C@H]1CC(Oc1cccnc1)C2.
What is the InChIKey of furan-3-yl-[(1S,5S)-3-pyridin-3-yloxy-8-azabicyclo[3.2.1]octan-8-yl]methanone?
The InChIKey is UBUWNHHQKZKTJP-KBPBESRZSA-N. The full InChI is InChI=1S/C17H18N2O3/c20-17(12-5-7-21-11-12)19-13-3-4-14(19)9-16(8-13)22-15-2-1-6-18-10-15/h1-2,5-7,10-11,13-14,16H,3-4,8-9H2/t13-,14-/m0/s1.
What are the key properties of furan-3-yl-[(1S,5S)-3-pyridin-3-yloxy-8-azabicyclo[3.2.1]octan-8-yl]methanone?
furan-3-yl-[(1S,5S)-3-pyridin-3-yloxy-8-azabicyclo[3.2.1]octan-8-yl]methanone has a molecular weight of 298.34 g/mol, XLogP of 2.89, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for furan-3-yl-[(1S,5S)-3-pyridin-3-yloxy-8-azabicyclo[3.2.1]octan-8-yl]methanone is sourced from PubChem (CID 129357635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).