2-methoxy-1-(2-pyridin-2-yl-2,7-diazaspiro[3.5]nonan-7-yl)ethanone

C15H21N3O2 — CID 3234154

IUPAC2-methoxy-1-(2-pyridin-2-yl-2,7-diazaspiro[3.5]nonan-7-yl)ethanone
SMILESCOCC(=O)N1CCC2(CC1)CN(c1ccccn1)C2
InChIInChI=1S/C15H21N3O2/c1-20-10-14(19)17-8-5-15(6-9-17)11-18(12-15)13-4-2-3-7-16-13/h2-4,7H,5-6,8-12H2,1H3
InChIKeyMEPCPABNZYHMAN-UHFFFAOYSA-N
MW275.35 g/mol
LogP1.16
Rot. Bonds3

About 2-methoxy-1-(2-pyridin-2-yl-2,7-diazaspiro[3.5]nonan-7-yl)ethanone

2-methoxy-1-(2-pyridin-2-yl-2,7-diazaspiro[3.5]nonan-7-yl)ethanone (PubChem CID 3234154) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is 2-methoxy-1-(2-pyridin-2-yl-2,7-diazaspiro[3.5]nonan-7-yl)ethanone.

Molecular Properties

Compound Name2-methoxy-1-(2-pyridin-2-yl-2,7-diazaspiro[3.5]nonan-7-yl)ethanone
PubChem CID3234154
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC Name2-methoxy-1-(2-pyridin-2-yl-2,7-diazaspiro[3.5]nonan-7-yl)ethanone
SMILESCOCC(=O)N1CCC2(CC1)CN(c1ccccn1)C2
InChIInChI=1S/C15H21N3O2/c1-20-10-14(19)17-8-5-15(6-9-17)11-18(12-15)13-4-2-3-7-16-13/h2-4,7H,5-6,8-12H2,1H3
InChIKeyMEPCPABNZYHMAN-UHFFFAOYSA-N
XLogP1.16
TPSA45.67 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 51.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-1-(2-pyridin-2-yl-2,7-diazaspiro[3.5]nonan-7-yl)ethanone?
The IUPAC name of 2-methoxy-1-(2-pyridin-2-yl-2,7-diazaspiro[3.5]nonan-7-yl)ethanone (CID 3234154) is 2-methoxy-1-(2-pyridin-2-yl-2,7-diazaspiro[3.5]nonan-7-yl)ethanone.
What is the SMILES notation for 2-methoxy-1-(2-pyridin-2-yl-2,7-diazaspiro[3.5]nonan-7-yl)ethanone?
The canonical SMILES for 2-methoxy-1-(2-pyridin-2-yl-2,7-diazaspiro[3.5]nonan-7-yl)ethanone is COCC(=O)N1CCC2(CC1)CN(c1ccccn1)C2.
What is the InChIKey of 2-methoxy-1-(2-pyridin-2-yl-2,7-diazaspiro[3.5]nonan-7-yl)ethanone?
The InChIKey is MEPCPABNZYHMAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c1-20-10-14(19)17-8-5-15(6-9-17)11-18(12-15)13-4-2-3-7-16-13/h2-4,7H,5-6,8-12H2,1H3.
What are the key properties of 2-methoxy-1-(2-pyridin-2-yl-2,7-diazaspiro[3.5]nonan-7-yl)ethanone?
2-methoxy-1-(2-pyridin-2-yl-2,7-diazaspiro[3.5]nonan-7-yl)ethanone has a molecular weight of 275.35 g/mol, XLogP of 1.16, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-1-(2-pyridin-2-yl-2,7-diazaspiro[3.5]nonan-7-yl)ethanone is sourced from PubChem (CID 3234154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).