4-methyl-7-azaspiro[4.5]decan-8-one

C10H17NO — CID 102737251

IUPAC4-methyl-7-azaspiro[4.5]decan-8-one
SMILESCC1CCCC12CCC(=O)NC2
InChIInChI=1S/C10H17NO/c1-8-3-2-5-10(8)6-4-9(12)11-7-10/h8H,2-7H2,1H3,(H,11,12)
InChIKeyHDPSLBWKYKNDNO-UHFFFAOYSA-N
MW167.25 g/mol
LogP1.70
Rot. Bonds

About 4-methyl-7-azaspiro[4.5]decan-8-one

4-methyl-7-azaspiro[4.5]decan-8-one (PubChem CID 102737251) has the molecular formula C10H17NO and a molecular weight of 167.25 g/mol. Its IUPAC name is 4-methyl-7-azaspiro[4.5]decan-8-one.

Molecular Properties

Compound Name4-methyl-7-azaspiro[4.5]decan-8-one
PubChem CID102737251
Molecular FormulaC10H17NO
Molecular Weight167.25 g/mol
Exact Mass167.13
IUPAC Name4-methyl-7-azaspiro[4.5]decan-8-one
SMILESCC1CCCC12CCC(=O)NC2
InChIInChI=1S/C10H17NO/c1-8-3-2-5-10(8)6-4-9(12)11-7-10/h8H,2-7H2,1H3,(H,11,12)
InChIKeyHDPSLBWKYKNDNO-UHFFFAOYSA-N
XLogP1.70
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.25
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-7-azaspiro[4.5]decan-8-one?
The IUPAC name of 4-methyl-7-azaspiro[4.5]decan-8-one (CID 102737251) is 4-methyl-7-azaspiro[4.5]decan-8-one.
What is the SMILES notation for 4-methyl-7-azaspiro[4.5]decan-8-one?
The canonical SMILES for 4-methyl-7-azaspiro[4.5]decan-8-one is CC1CCCC12CCC(=O)NC2.
What is the InChIKey of 4-methyl-7-azaspiro[4.5]decan-8-one?
The InChIKey is HDPSLBWKYKNDNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO/c1-8-3-2-5-10(8)6-4-9(12)11-7-10/h8H,2-7H2,1H3,(H,11,12).
What are the key properties of 4-methyl-7-azaspiro[4.5]decan-8-one?
4-methyl-7-azaspiro[4.5]decan-8-one has a molecular weight of 167.25 g/mol, XLogP of 1.70, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-7-azaspiro[4.5]decan-8-one is sourced from PubChem (CID 102737251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).