4-(methoxymethyl)-8-[(6-methoxy-2-pyridinyl)methyl]-2-methyl-2,8-diazaspiro[4.5]decane

C18H29N3O2 — CID 91922088

IUPAC4-(methoxymethyl)-8-[(6-methoxy-2-pyridinyl)methyl]-2-methyl-2,8-diazaspiro[4.5]decane
SMILESCOCC1CN(C)CC12CCN(Cc1cccc(OC)n1)CC2
InChIInChI=1S/C18H29N3O2/c1-20-11-15(13-22-2)18(14-20)7-9-21(10-8-18)12-16-5-4-6-17(19-16)23-3/h4-6,15H,7-14H2,1-3H3
InChIKeyYUMGCBHBIRMXMV-UHFFFAOYSA-N
MW319.45 g/mol
LogP1.88
Rot. Bonds5

About 4-(methoxymethyl)-8-[(6-methoxy-2-pyridinyl)methyl]-2-methyl-2,8-diazaspiro[4.5]decane

4-(methoxymethyl)-8-[(6-methoxy-2-pyridinyl)methyl]-2-methyl-2,8-diazaspiro[4.5]decane (PubChem CID 91922088) has the molecular formula C18H29N3O2 and a molecular weight of 319.45 g/mol. Its IUPAC name is 4-(methoxymethyl)-8-[(6-methoxy-2-pyridinyl)methyl]-2-methyl-2,8-diazaspiro[4.5]decane.

Molecular Properties

Compound Name4-(methoxymethyl)-8-[(6-methoxy-2-pyridinyl)methyl]-2-methyl-2,8-diazaspiro[4.5]decane
PubChem CID91922088
Molecular FormulaC18H29N3O2
Molecular Weight319.45 g/mol
Exact Mass319.23
IUPAC Name4-(methoxymethyl)-8-[(6-methoxy-2-pyridinyl)methyl]-2-methyl-2,8-diazaspiro[4.5]decane
SMILESCOCC1CN(C)CC12CCN(Cc1cccc(OC)n1)CC2
InChIInChI=1S/C18H29N3O2/c1-20-11-15(13-22-2)18(14-20)7-9-21(10-8-18)12-16-5-4-6-17(19-16)23-3/h4-6,15H,7-14H2,1-3H3
InChIKeyYUMGCBHBIRMXMV-UHFFFAOYSA-N
XLogP1.88
TPSA37.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.45
LogP ≤ 51.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(methoxymethyl)-8-[(6-methoxy-2-pyridinyl)methyl]-2-methyl-2,8-diazaspiro[4.5]decane?
The IUPAC name of 4-(methoxymethyl)-8-[(6-methoxy-2-pyridinyl)methyl]-2-methyl-2,8-diazaspiro[4.5]decane (CID 91922088) is 4-(methoxymethyl)-8-[(6-methoxy-2-pyridinyl)methyl]-2-methyl-2,8-diazaspiro[4.5]decane.
What is the SMILES notation for 4-(methoxymethyl)-8-[(6-methoxy-2-pyridinyl)methyl]-2-methyl-2,8-diazaspiro[4.5]decane?
The canonical SMILES for 4-(methoxymethyl)-8-[(6-methoxy-2-pyridinyl)methyl]-2-methyl-2,8-diazaspiro[4.5]decane is COCC1CN(C)CC12CCN(Cc1cccc(OC)n1)CC2.
What is the InChIKey of 4-(methoxymethyl)-8-[(6-methoxy-2-pyridinyl)methyl]-2-methyl-2,8-diazaspiro[4.5]decane?
The InChIKey is YUMGCBHBIRMXMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29N3O2/c1-20-11-15(13-22-2)18(14-20)7-9-21(10-8-18)12-16-5-4-6-17(19-16)23-3/h4-6,15H,7-14H2,1-3H3.
What are the key properties of 4-(methoxymethyl)-8-[(6-methoxy-2-pyridinyl)methyl]-2-methyl-2,8-diazaspiro[4.5]decane?
4-(methoxymethyl)-8-[(6-methoxy-2-pyridinyl)methyl]-2-methyl-2,8-diazaspiro[4.5]decane has a molecular weight of 319.45 g/mol, XLogP of 1.88, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methoxymethyl)-8-[(6-methoxy-2-pyridinyl)methyl]-2-methyl-2,8-diazaspiro[4.5]decane is sourced from PubChem (CID 91922088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).