9-methyl-1-(5-methylpyridine-3-carbonyl)-1,9-diazaspiro[4.5]decan-10-one

C16H21N3O2 — CID 163316091

IUPAC9-methyl-1-(5-methylpyridine-3-carbonyl)-1,9-diazaspiro[4.5]decan-10-one
SMILESCc1cncc(C(=O)N2CCCC23CCCN(C)C3=O)c1
InChIInChI=1S/C16H21N3O2/c1-12-9-13(11-17-10-12)14(20)19-8-4-6-16(19)5-3-7-18(2)15(16)21/h9-11H,3-8H2,1-2H3
InChIKeyMOWFAMUHUXWESM-UHFFFAOYSA-N
MW287.36 g/mol
LogP1.62
Rot. Bonds1

About 9-methyl-1-(5-methylpyridine-3-carbonyl)-1,9-diazaspiro[4.5]decan-10-one

9-methyl-1-(5-methylpyridine-3-carbonyl)-1,9-diazaspiro[4.5]decan-10-one (PubChem CID 163316091) has the molecular formula C16H21N3O2 and a molecular weight of 287.36 g/mol. Its IUPAC name is 9-methyl-1-(5-methylpyridine-3-carbonyl)-1,9-diazaspiro[4.5]decan-10-one.

Molecular Properties

Compound Name9-methyl-1-(5-methylpyridine-3-carbonyl)-1,9-diazaspiro[4.5]decan-10-one
PubChem CID163316091
Molecular FormulaC16H21N3O2
Molecular Weight287.36 g/mol
Exact Mass287.16
IUPAC Name9-methyl-1-(5-methylpyridine-3-carbonyl)-1,9-diazaspiro[4.5]decan-10-one
SMILESCc1cncc(C(=O)N2CCCC23CCCN(C)C3=O)c1
InChIInChI=1S/C16H21N3O2/c1-12-9-13(11-17-10-12)14(20)19-8-4-6-16(19)5-3-7-18(2)15(16)21/h9-11H,3-8H2,1-2H3
InChIKeyMOWFAMUHUXWESM-UHFFFAOYSA-N
XLogP1.62
TPSA53.51 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 51.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 9-methyl-1-(5-methylpyridine-3-carbonyl)-1,9-diazaspiro[4.5]decan-10-one?
The IUPAC name of 9-methyl-1-(5-methylpyridine-3-carbonyl)-1,9-diazaspiro[4.5]decan-10-one (CID 163316091) is 9-methyl-1-(5-methylpyridine-3-carbonyl)-1,9-diazaspiro[4.5]decan-10-one.
What is the SMILES notation for 9-methyl-1-(5-methylpyridine-3-carbonyl)-1,9-diazaspiro[4.5]decan-10-one?
The canonical SMILES for 9-methyl-1-(5-methylpyridine-3-carbonyl)-1,9-diazaspiro[4.5]decan-10-one is Cc1cncc(C(=O)N2CCCC23CCCN(C)C3=O)c1.
What is the InChIKey of 9-methyl-1-(5-methylpyridine-3-carbonyl)-1,9-diazaspiro[4.5]decan-10-one?
The InChIKey is MOWFAMUHUXWESM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O2/c1-12-9-13(11-17-10-12)14(20)19-8-4-6-16(19)5-3-7-18(2)15(16)21/h9-11H,3-8H2,1-2H3.
What are the key properties of 9-methyl-1-(5-methylpyridine-3-carbonyl)-1,9-diazaspiro[4.5]decan-10-one?
9-methyl-1-(5-methylpyridine-3-carbonyl)-1,9-diazaspiro[4.5]decan-10-one has a molecular weight of 287.36 g/mol, XLogP of 1.62, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methyl-1-(5-methylpyridine-3-carbonyl)-1,9-diazaspiro[4.5]decan-10-one is sourced from PubChem (CID 163316091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).