2-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-2,8-diazaspiro[4.5]decan-3-one

C16H23N3O2 — CID 82884161

IUPAC2-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-2,8-diazaspiro[4.5]decan-3-one
SMILESCOc1cc(C)nc(CN2CC3(CCNCC3)CC2=O)c1
InChIInChI=1S/C16H23N3O2/c1-12-7-14(21-2)8-13(18-12)10-19-11-16(9-15(19)20)3-5-17-6-4-16/h7-8,17H,3-6,9-11H2,1-2H3
InChIKeyQXZRLDSEAVHPCU-UHFFFAOYSA-N
MW289.38 g/mol
LogP1.50
Rot. Bonds3

About 2-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-2,8-diazaspiro[4.5]decan-3-one

2-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-2,8-diazaspiro[4.5]decan-3-one (PubChem CID 82884161) has the molecular formula C16H23N3O2 and a molecular weight of 289.38 g/mol. Its IUPAC name is 2-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-2,8-diazaspiro[4.5]decan-3-one.

Molecular Properties

Compound Name2-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-2,8-diazaspiro[4.5]decan-3-one
PubChem CID82884161
Molecular FormulaC16H23N3O2
Molecular Weight289.38 g/mol
Exact Mass289.18
IUPAC Name2-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-2,8-diazaspiro[4.5]decan-3-one
SMILESCOc1cc(C)nc(CN2CC3(CCNCC3)CC2=O)c1
InChIInChI=1S/C16H23N3O2/c1-12-7-14(21-2)8-13(18-12)10-19-11-16(9-15(19)20)3-5-17-6-4-16/h7-8,17H,3-6,9-11H2,1-2H3
InChIKeyQXZRLDSEAVHPCU-UHFFFAOYSA-N
XLogP1.50
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-2,8-diazaspiro[4.5]decan-3-one with MolForge

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Related Compounds

2-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-2,8-diazaspiro[4.5]decane
CID 120906860
2-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-2,8-diazaspiro[4.5]decane;hydrochloride
CID 120906859
2-(2,3-dihydro-[1,4]dioxino[2,3-c]pyridin-7-ylmethyl)-2,8-diazaspiro[4.5]decan-3-one
CID 70648268
1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-5-oxopyrrolidine-3-carboxylic acid
CID 83192816
2-[(2-methyl-1,3-thiazol-4-yl)methyl]-2,9-diazaspiro[5.5]undecan-3-one
CID 70776926
2-[(3,4-difluorophenyl)methyl]-2,8-diazaspiro[4.5]decan-3-one
CID 82930927
1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-2,2,5-trimethylpiperazine
CID 82895253
1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-3,5-dimethylpiperazine
CID 82893576
1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]piperidin-3-one
CID 82892859
1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-3-propylpiperazine
CID 82895805
1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]piperidine-2-carbaldehyde
CID 82896519
[4-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-6,6-dimethylmorpholin-2-yl]methanol
CID 114779906

Frequently Asked Questions

What is the IUPAC name of 2-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-2,8-diazaspiro[4.5]decan-3-one?
The IUPAC name of 2-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-2,8-diazaspiro[4.5]decan-3-one (CID 82884161) is 2-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-2,8-diazaspiro[4.5]decan-3-one.
What is the SMILES notation for 2-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-2,8-diazaspiro[4.5]decan-3-one?
The canonical SMILES for 2-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-2,8-diazaspiro[4.5]decan-3-one is COc1cc(C)nc(CN2CC3(CCNCC3)CC2=O)c1.
What is the InChIKey of 2-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-2,8-diazaspiro[4.5]decan-3-one?
The InChIKey is QXZRLDSEAVHPCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2/c1-12-7-14(21-2)8-13(18-12)10-19-11-16(9-15(19)20)3-5-17-6-4-16/h7-8,17H,3-6,9-11H2,1-2H3.
What are the key properties of 2-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-2,8-diazaspiro[4.5]decan-3-one?
2-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-2,8-diazaspiro[4.5]decan-3-one has a molecular weight of 289.38 g/mol, XLogP of 1.50, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-2,8-diazaspiro[4.5]decan-3-one is sourced from PubChem (CID 82884161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).