6-methylcyclodecan-1-one

C11H20O — CID 121216307

IUPAC6-methylcyclodecan-1-one
SMILESCC1CCCCC(=O)CCCC1
InChIInChI=1S/C11H20O/c1-10-6-2-4-8-11(12)9-5-3-7-10/h10H,2-9H2,1H3
InChIKeyYKRDFJFQWIKNMT-UHFFFAOYSA-N
MW168.28 g/mol
LogP3.33
Rot. Bonds

About 6-methylcyclodecan-1-one

6-methylcyclodecan-1-one (PubChem CID 121216307) has the molecular formula C11H20O and a molecular weight of 168.28 g/mol. Its IUPAC name is 6-methylcyclodecan-1-one.

Molecular Properties

Compound Name6-methylcyclodecan-1-one
PubChem CID121216307
Molecular FormulaC11H20O
Molecular Weight168.28 g/mol
Exact Mass168.15
IUPAC Name6-methylcyclodecan-1-one
SMILESCC1CCCCC(=O)CCCC1
InChIInChI=1S/C11H20O/c1-10-6-2-4-8-11(12)9-5-3-7-10/h10H,2-9H2,1H3
InChIKeyYKRDFJFQWIKNMT-UHFFFAOYSA-N
XLogP3.33
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 53.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-methylcycloheptan-1-one
CID 534955
3-methylcyclooctan-1-one
CID 12892221
3-(113C)methylcyclohexan-1-one
CID 11708054
methylcyclopentane
CID 7296
3-methylcyclopentadecane-1,5-dione
CID 11184330
6-ethylcyclodecan-1-one
CID 18176981
cycloheptanone;cyclohexanone;cyclopentanone;ethane
CID 158721030
CID 162230812
CID 162230812
cyclotricosanone
CID 54375596
cyclohexane;methylcyclopentane
CID 20788572
CID 158187464
CID 158187464
erbium;tris(methylcyclopentane)
CID 91996115

Frequently Asked Questions

What is the IUPAC name of 6-methylcyclodecan-1-one?
The IUPAC name of 6-methylcyclodecan-1-one (CID 121216307) is 6-methylcyclodecan-1-one.
What is the SMILES notation for 6-methylcyclodecan-1-one?
The canonical SMILES for 6-methylcyclodecan-1-one is CC1CCCCC(=O)CCCC1.
What is the InChIKey of 6-methylcyclodecan-1-one?
The InChIKey is YKRDFJFQWIKNMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O/c1-10-6-2-4-8-11(12)9-5-3-7-10/h10H,2-9H2,1H3.
What are the key properties of 6-methylcyclodecan-1-one?
6-methylcyclodecan-1-one has a molecular weight of 168.28 g/mol, XLogP of 3.33, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methylcyclodecan-1-one is sourced from PubChem (CID 121216307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).