pyridin-4-yl-(2-pyridin-3-yloxy-7-azaspiro[3.5]nonan-7-yl)methanone

C19H21N3O2 — CID 97385687

IUPACpyridin-4-yl-(2-pyridin-3-yloxy-7-azaspiro[3.5]nonan-7-yl)methanone
SMILESO=C(c1ccncc1)N1CCC2(CC1)CC(Oc1cccnc1)C2
InChIInChI=1S/C19H21N3O2/c23-18(15-3-8-20-9-4-15)22-10-5-19(6-11-22)12-17(13-19)24-16-2-1-7-21-14-16/h1-4,7-9,14,17H,5-6,10-13H2
InChIKeyMKAHYGZXRCYUEK-UHFFFAOYSA-N
MW323.40 g/mol
LogP2.94
Rot. Bonds3

About pyridin-4-yl-(2-pyridin-3-yloxy-7-azaspiro[3.5]nonan-7-yl)methanone

pyridin-4-yl-(2-pyridin-3-yloxy-7-azaspiro[3.5]nonan-7-yl)methanone (PubChem CID 97385687) has the molecular formula C19H21N3O2 and a molecular weight of 323.40 g/mol. Its IUPAC name is pyridin-4-yl-(2-pyridin-3-yloxy-7-azaspiro[3.5]nonan-7-yl)methanone.

Molecular Properties

Compound Namepyridin-4-yl-(2-pyridin-3-yloxy-7-azaspiro[3.5]nonan-7-yl)methanone
PubChem CID97385687
Molecular FormulaC19H21N3O2
Molecular Weight323.40 g/mol
Exact Mass323.16
IUPAC Namepyridin-4-yl-(2-pyridin-3-yloxy-7-azaspiro[3.5]nonan-7-yl)methanone
SMILESO=C(c1ccncc1)N1CCC2(CC1)CC(Oc1cccnc1)C2
InChIInChI=1S/C19H21N3O2/c23-18(15-3-8-20-9-4-15)22-10-5-19(6-11-22)12-17(13-19)24-16-2-1-7-21-14-16/h1-4,7-9,14,17H,5-6,10-13H2
InChIKeyMKAHYGZXRCYUEK-UHFFFAOYSA-N
XLogP2.94
TPSA55.32 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.40
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

pyrazin-2-yl-(2-pyridin-3-yloxy-7-azaspiro[3.5]nonan-7-yl)methanone
CID 97451301
(3-fluorophenyl)-(2-pyridin-3-yloxy-7-azaspiro[3.5]nonan-7-yl)methanone;2,2,2-trifluoroacetic acid
CID 155826996
(2-methylfuran-3-yl)-(2-pyridin-3-yloxy-7-azaspiro[3.5]nonan-7-yl)methanone
CID 97451294
(2-methoxy-7-azaspiro[3.5]nonan-7-yl)-pyridin-3-ylmethanone
CID 97451282
pyridin-4-yl-(3-pyridin-3-yloxypyrrolidin-1-yl)methanone
CID 110876433
pyridin-4-yl-[(3S,5R)-3-pyridin-3-yloxy-1-oxa-9-azaspiro[4.5]decan-9-yl]methanone
CID 97409097
pyridin-4-yl-[(3R,5S)-3-pyridin-3-yloxy-1-oxa-9-azaspiro[4.5]decan-9-yl]methanone
CID 97409098
4-(4-pyridin-3-yloxypiperidine-1-carbonyl)benzenesulfonamide
CID 77094306
(4-pyridin-3-yloxypiperidin-1-yl)-(4-pyrrolidin-1-ylphenyl)methanone
CID 90649725
(3-pyridin-3-yloxy-1-oxa-8-azaspiro[4.5]decan-8-yl)-(1H-pyrrol-2-yl)methanone
CID 118741128
pyridin-2-yl-[(3R)-3-pyridin-3-yloxy-1-oxa-8-azaspiro[4.5]decan-8-yl]methanone
CID 97395040
(1-methylpyrazol-4-yl)-[(3R,5S)-3-pyridin-3-yloxy-1-oxa-7-azaspiro[4.4]nonan-7-yl]methanone
CID 97419987

Frequently Asked Questions

What is the IUPAC name of pyridin-4-yl-(2-pyridin-3-yloxy-7-azaspiro[3.5]nonan-7-yl)methanone?
The IUPAC name of pyridin-4-yl-(2-pyridin-3-yloxy-7-azaspiro[3.5]nonan-7-yl)methanone (CID 97385687) is pyridin-4-yl-(2-pyridin-3-yloxy-7-azaspiro[3.5]nonan-7-yl)methanone.
What is the SMILES notation for pyridin-4-yl-(2-pyridin-3-yloxy-7-azaspiro[3.5]nonan-7-yl)methanone?
The canonical SMILES for pyridin-4-yl-(2-pyridin-3-yloxy-7-azaspiro[3.5]nonan-7-yl)methanone is O=C(c1ccncc1)N1CCC2(CC1)CC(Oc1cccnc1)C2.
What is the InChIKey of pyridin-4-yl-(2-pyridin-3-yloxy-7-azaspiro[3.5]nonan-7-yl)methanone?
The InChIKey is MKAHYGZXRCYUEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O2/c23-18(15-3-8-20-9-4-15)22-10-5-19(6-11-22)12-17(13-19)24-16-2-1-7-21-14-16/h1-4,7-9,14,17H,5-6,10-13H2.
What are the key properties of pyridin-4-yl-(2-pyridin-3-yloxy-7-azaspiro[3.5]nonan-7-yl)methanone?
pyridin-4-yl-(2-pyridin-3-yloxy-7-azaspiro[3.5]nonan-7-yl)methanone has a molecular weight of 323.40 g/mol, XLogP of 2.94, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for pyridin-4-yl-(2-pyridin-3-yloxy-7-azaspiro[3.5]nonan-7-yl)methanone is sourced from PubChem (CID 97385687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).