pyrazin-2-yl-(2-pyridin-3-yloxy-7-azaspiro[3.5]nonan-7-yl)methanone

C18H20N4O2 — CID 97451301

IUPACpyrazin-2-yl-(2-pyridin-3-yloxy-7-azaspiro[3.5]nonan-7-yl)methanone
SMILESO=C(c1cnccn1)N1CCC2(CC1)CC(Oc1cccnc1)C2
InChIInChI=1S/C18H20N4O2/c23-17(16-13-20-6-7-21-16)22-8-3-18(4-9-22)10-15(11-18)24-14-2-1-5-19-12-14/h1-2,5-7,12-13,15H,3-4,8-11H2
InChIKeyXABZSKVVGCANDQ-UHFFFAOYSA-N
MW324.38 g/mol
LogP2.34
Rot. Bonds3

About pyrazin-2-yl-(2-pyridin-3-yloxy-7-azaspiro[3.5]nonan-7-yl)methanone

pyrazin-2-yl-(2-pyridin-3-yloxy-7-azaspiro[3.5]nonan-7-yl)methanone (PubChem CID 97451301) has the molecular formula C18H20N4O2 and a molecular weight of 324.38 g/mol. Its IUPAC name is pyrazin-2-yl-(2-pyridin-3-yloxy-7-azaspiro[3.5]nonan-7-yl)methanone.

Molecular Properties

Compound Namepyrazin-2-yl-(2-pyridin-3-yloxy-7-azaspiro[3.5]nonan-7-yl)methanone
PubChem CID97451301
Molecular FormulaC18H20N4O2
Molecular Weight324.38 g/mol
Exact Mass324.16
IUPAC Namepyrazin-2-yl-(2-pyridin-3-yloxy-7-azaspiro[3.5]nonan-7-yl)methanone
SMILESO=C(c1cnccn1)N1CCC2(CC1)CC(Oc1cccnc1)C2
InChIInChI=1S/C18H20N4O2/c23-17(16-13-20-6-7-21-16)22-8-3-18(4-9-22)10-15(11-18)24-14-2-1-5-19-12-14/h1-2,5-7,12-13,15H,3-4,8-11H2
InChIKeyXABZSKVVGCANDQ-UHFFFAOYSA-N
XLogP2.34
TPSA68.21 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

pyridin-4-yl-(2-pyridin-3-yloxy-7-azaspiro[3.5]nonan-7-yl)methanone
CID 97385687
(2-methylfuran-3-yl)-(2-pyridin-3-yloxy-7-azaspiro[3.5]nonan-7-yl)methanone
CID 97451294
pyridin-2-yl-[(3R)-3-pyridin-3-yloxy-1-oxa-8-azaspiro[4.5]decan-8-yl]methanone
CID 97395040
(3-fluorophenyl)-(2-pyridin-3-yloxy-7-azaspiro[3.5]nonan-7-yl)methanone;2,2,2-trifluoroacetic acid
CID 155826996
(2-methoxy-7-azaspiro[3.5]nonan-7-yl)-pyridin-3-ylmethanone
CID 97451282
[4-(3-fluorophenoxy)piperidin-1-yl]-pyrazin-2-ylmethanone
CID 95811364
(5-bromo-2-pyridinyl)-(4-pyridin-3-yloxypiperidin-1-yl)methanone
CID 56643230
pyridin-2-yl-[(3S,5R)-3-pyridin-3-yloxy-1-oxa-9-azaspiro[4.5]decan-9-yl]methanone
CID 97371619
[(4S)-2-cyclopropyl-4-phenyl-2,9-diazaspiro[5.5]undecan-9-yl]-pyrazin-2-ylmethanone
CID 97200921
(3-pyridin-3-yloxy-1-oxa-8-azaspiro[4.5]decan-8-yl)-(1H-pyrrol-2-yl)methanone
CID 118741128
[2-[(4-methoxyphenyl)methyl]-2,8-diazaspiro[4.5]decan-8-yl]-pyrazin-2-ylmethanone
CID 97370069
[2-[(2-methoxyphenyl)methyl]-2,7-diazaspiro[3.5]nonan-7-yl]-pyrazin-2-ylmethanone
CID 3233419

Frequently Asked Questions

What is the IUPAC name of pyrazin-2-yl-(2-pyridin-3-yloxy-7-azaspiro[3.5]nonan-7-yl)methanone?
The IUPAC name of pyrazin-2-yl-(2-pyridin-3-yloxy-7-azaspiro[3.5]nonan-7-yl)methanone (CID 97451301) is pyrazin-2-yl-(2-pyridin-3-yloxy-7-azaspiro[3.5]nonan-7-yl)methanone.
What is the SMILES notation for pyrazin-2-yl-(2-pyridin-3-yloxy-7-azaspiro[3.5]nonan-7-yl)methanone?
The canonical SMILES for pyrazin-2-yl-(2-pyridin-3-yloxy-7-azaspiro[3.5]nonan-7-yl)methanone is O=C(c1cnccn1)N1CCC2(CC1)CC(Oc1cccnc1)C2.
What is the InChIKey of pyrazin-2-yl-(2-pyridin-3-yloxy-7-azaspiro[3.5]nonan-7-yl)methanone?
The InChIKey is XABZSKVVGCANDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4O2/c23-17(16-13-20-6-7-21-16)22-8-3-18(4-9-22)10-15(11-18)24-14-2-1-5-19-12-14/h1-2,5-7,12-13,15H,3-4,8-11H2.
What are the key properties of pyrazin-2-yl-(2-pyridin-3-yloxy-7-azaspiro[3.5]nonan-7-yl)methanone?
pyrazin-2-yl-(2-pyridin-3-yloxy-7-azaspiro[3.5]nonan-7-yl)methanone has a molecular weight of 324.38 g/mol, XLogP of 2.34, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for pyrazin-2-yl-(2-pyridin-3-yloxy-7-azaspiro[3.5]nonan-7-yl)methanone is sourced from PubChem (CID 97451301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).