1-methyl-6-propan-2-yloxy-1-azaspiro[4.5]decane

C13H25NO — CID 177126304

IUPAC1-methyl-6-propan-2-yloxy-1-azaspiro[4.5]decane
SMILESCC(C)OC1CCCCC12CCCN2C
InChIInChI=1S/C13H25NO/c1-11(2)15-12-7-4-5-8-13(12)9-6-10-14(13)3/h11-12H,4-10H2,1-3H3
InChIKeyGGRXWIPQZNTWOO-UHFFFAOYSA-N
MW211.35 g/mol
LogP2.82
Rot. Bonds2

About 1-methyl-6-propan-2-yloxy-1-azaspiro[4.5]decane

1-methyl-6-propan-2-yloxy-1-azaspiro[4.5]decane (PubChem CID 177126304) has the molecular formula C13H25NO and a molecular weight of 211.35 g/mol. Its IUPAC name is 1-methyl-6-propan-2-yloxy-1-azaspiro[4.5]decane.

Molecular Properties

Compound Name1-methyl-6-propan-2-yloxy-1-azaspiro[4.5]decane
PubChem CID177126304
Molecular FormulaC13H25NO
Molecular Weight211.35 g/mol
Exact Mass211.19
IUPAC Name1-methyl-6-propan-2-yloxy-1-azaspiro[4.5]decane
SMILESCC(C)OC1CCCCC12CCCN2C
InChIInChI=1S/C13H25NO/c1-11(2)15-12-7-4-5-8-13(12)9-6-10-14(13)3/h11-12H,4-10H2,1-3H3
InChIKeyGGRXWIPQZNTWOO-UHFFFAOYSA-N
XLogP2.82
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-6-propan-2-yloxy-1-azaspiro[4.5]decane?
The IUPAC name of 1-methyl-6-propan-2-yloxy-1-azaspiro[4.5]decane (CID 177126304) is 1-methyl-6-propan-2-yloxy-1-azaspiro[4.5]decane.
What is the SMILES notation for 1-methyl-6-propan-2-yloxy-1-azaspiro[4.5]decane?
The canonical SMILES for 1-methyl-6-propan-2-yloxy-1-azaspiro[4.5]decane is CC(C)OC1CCCCC12CCCN2C.
What is the InChIKey of 1-methyl-6-propan-2-yloxy-1-azaspiro[4.5]decane?
The InChIKey is GGRXWIPQZNTWOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO/c1-11(2)15-12-7-4-5-8-13(12)9-6-10-14(13)3/h11-12H,4-10H2,1-3H3.
What are the key properties of 1-methyl-6-propan-2-yloxy-1-azaspiro[4.5]decane?
1-methyl-6-propan-2-yloxy-1-azaspiro[4.5]decane has a molecular weight of 211.35 g/mol, XLogP of 2.82, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-6-propan-2-yloxy-1-azaspiro[4.5]decane is sourced from PubChem (CID 177126304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).