cyclobutyl-(1-methoxycyclobutyl)methanone

C10H16O2 — CID 116706787

IUPACcyclobutyl-(1-methoxycyclobutyl)methanone
SMILESCOC1(C(=O)C2CCC2)CCC1
InChIInChI=1S/C10H16O2/c1-12-10(6-3-7-10)9(11)8-4-2-5-8/h8H,2-7H2,1H3
InChIKeyUBYJMRJKCYZMLM-UHFFFAOYSA-N
MW168.24 g/mol
LogP1.92
Rot. Bonds3

About cyclobutyl-(1-methoxycyclobutyl)methanone

cyclobutyl-(1-methoxycyclobutyl)methanone (PubChem CID 116706787) has the molecular formula C10H16O2 and a molecular weight of 168.24 g/mol. Its IUPAC name is cyclobutyl-(1-methoxycyclobutyl)methanone.

Molecular Properties

Compound Namecyclobutyl-(1-methoxycyclobutyl)methanone
PubChem CID116706787
Molecular FormulaC10H16O2
Molecular Weight168.24 g/mol
Exact Mass168.12
IUPAC Namecyclobutyl-(1-methoxycyclobutyl)methanone
SMILESCOC1(C(=O)C2CCC2)CCC1
InChIInChI=1S/C10H16O2/c1-12-10(6-3-7-10)9(11)8-4-2-5-8/h8H,2-7H2,1H3
InChIKeyUBYJMRJKCYZMLM-UHFFFAOYSA-N
XLogP1.92
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.24
LogP ≤ 51.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(1-methoxycycloheptyl)-(oxan-4-yl)methanone
CID 116750496
cyclobutyl-(1-ethoxy-3-methylcyclohexyl)methanone
CID 116749804
cyclobutyl-(1-ethoxy-4-methylcyclohexyl)methanone
CID 116749325
(3-methoxyoxolan-3-yl)-(oxan-4-yl)methanone
CID 131001089
2-cyclopentyl-1-(1-methoxycyclopentyl)ethanone
CID 104610038
1-cyclobutyl-2-(1-methoxycyclobutyl)ethanone
CID 103558973
1-(cyclobutanecarbonyl)cyclobutane-1-carbaldehyde
CID 131101925
methyl 1-(cyclohexanecarbonyl)cyclopentane-1-carboxylate
CID 86032641
2-cyclobutyl-1-(1-methoxy-3-methylcyclohexyl)ethanone
CID 116749721
1-(1-methoxycycloheptyl)ethanone
CID 83225564
methyl 4-(cyclohexanecarbonyl)bicyclo[2.2.2]octane-1-carboxylate
CID 134962529
1-(1-methoxycyclohexyl)prop-2-yn-1-one
CID 116748025

Frequently Asked Questions

What is the IUPAC name of cyclobutyl-(1-methoxycyclobutyl)methanone?
The IUPAC name of cyclobutyl-(1-methoxycyclobutyl)methanone (CID 116706787) is cyclobutyl-(1-methoxycyclobutyl)methanone.
What is the SMILES notation for cyclobutyl-(1-methoxycyclobutyl)methanone?
The canonical SMILES for cyclobutyl-(1-methoxycyclobutyl)methanone is COC1(C(=O)C2CCC2)CCC1.
What is the InChIKey of cyclobutyl-(1-methoxycyclobutyl)methanone?
The InChIKey is UBYJMRJKCYZMLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O2/c1-12-10(6-3-7-10)9(11)8-4-2-5-8/h8H,2-7H2,1H3.
What are the key properties of cyclobutyl-(1-methoxycyclobutyl)methanone?
cyclobutyl-(1-methoxycyclobutyl)methanone has a molecular weight of 168.24 g/mol, XLogP of 1.92, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclobutyl-(1-methoxycyclobutyl)methanone is sourced from PubChem (CID 116706787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).