2-methyl-N-(spiro[2.5]octan-2-ylmethyl)propanamide

C13H23NO — CID 162496164

IUPAC2-methyl-N-(spiro[2.5]octan-2-ylmethyl)propanamide
SMILESCC(C)C(=O)NCC1CC12CCCCC2
InChIInChI=1S/C13H23NO/c1-10(2)12(15)14-9-11-8-13(11)6-4-3-5-7-13/h10-11H,3-9H2,1-2H3,(H,14,15)
InChIKeyCUHWHKNPQPXGJN-UHFFFAOYSA-N
MW209.33 g/mol
LogP2.73
Rot. Bonds3

About 2-methyl-N-(spiro[2.5]octan-2-ylmethyl)propanamide

2-methyl-N-(spiro[2.5]octan-2-ylmethyl)propanamide (PubChem CID 162496164) has the molecular formula C13H23NO and a molecular weight of 209.33 g/mol. Its IUPAC name is 2-methyl-N-(spiro[2.5]octan-2-ylmethyl)propanamide.

Molecular Properties

Compound Name2-methyl-N-(spiro[2.5]octan-2-ylmethyl)propanamide
PubChem CID162496164
Molecular FormulaC13H23NO
Molecular Weight209.33 g/mol
Exact Mass209.18
IUPAC Name2-methyl-N-(spiro[2.5]octan-2-ylmethyl)propanamide
SMILESCC(C)C(=O)NCC1CC12CCCCC2
InChIInChI=1S/C13H23NO/c1-10(2)12(15)14-9-11-8-13(11)6-4-3-5-7-13/h10-11H,3-9H2,1-2H3,(H,14,15)
InChIKeyCUHWHKNPQPXGJN-UHFFFAOYSA-N
XLogP2.73
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.33
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(spiro[2.5]octan-2-ylmethyl)propanamide?
The IUPAC name of 2-methyl-N-(spiro[2.5]octan-2-ylmethyl)propanamide (CID 162496164) is 2-methyl-N-(spiro[2.5]octan-2-ylmethyl)propanamide.
What is the SMILES notation for 2-methyl-N-(spiro[2.5]octan-2-ylmethyl)propanamide?
The canonical SMILES for 2-methyl-N-(spiro[2.5]octan-2-ylmethyl)propanamide is CC(C)C(=O)NCC1CC12CCCCC2.
What is the InChIKey of 2-methyl-N-(spiro[2.5]octan-2-ylmethyl)propanamide?
The InChIKey is CUHWHKNPQPXGJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO/c1-10(2)12(15)14-9-11-8-13(11)6-4-3-5-7-13/h10-11H,3-9H2,1-2H3,(H,14,15).
What are the key properties of 2-methyl-N-(spiro[2.5]octan-2-ylmethyl)propanamide?
2-methyl-N-(spiro[2.5]octan-2-ylmethyl)propanamide has a molecular weight of 209.33 g/mol, XLogP of 2.73, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(spiro[2.5]octan-2-ylmethyl)propanamide is sourced from PubChem (CID 162496164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).