1-(bromomethyl)-1-(2-methoxyethoxymethyl)cyclopentane

C10H19BrO2 — CID 65001082

IUPAC1-(bromomethyl)-1-(2-methoxyethoxymethyl)cyclopentane
SMILESCOCCOCC1(CBr)CCCC1
InChIInChI=1S/C10H19BrO2/c1-12-6-7-13-9-10(8-11)4-2-3-5-10/h2-9H2,1H3
InChIKeyDLROGRZFKAEEQY-UHFFFAOYSA-N
MW251.16 g/mol
LogP2.60
Rot. Bonds6

About 1-(bromomethyl)-1-(2-methoxyethoxymethyl)cyclopentane

1-(bromomethyl)-1-(2-methoxyethoxymethyl)cyclopentane (PubChem CID 65001082) has the molecular formula C10H19BrO2 and a molecular weight of 251.16 g/mol. Its IUPAC name is 1-(bromomethyl)-1-(2-methoxyethoxymethyl)cyclopentane.

Molecular Properties

Compound Name1-(bromomethyl)-1-(2-methoxyethoxymethyl)cyclopentane
PubChem CID65001082
Molecular FormulaC10H19BrO2
Molecular Weight251.16 g/mol
Exact Mass250.06
IUPAC Name1-(bromomethyl)-1-(2-methoxyethoxymethyl)cyclopentane
SMILESCOCCOCC1(CBr)CCCC1
InChIInChI=1S/C10H19BrO2/c1-12-6-7-13-9-10(8-11)4-2-3-5-10/h2-9H2,1H3
InChIKeyDLROGRZFKAEEQY-UHFFFAOYSA-N
XLogP2.60
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.16
LogP ≤ 52.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

1-(bromomethyl)-1-(2-methoxyethoxymethyl)cyclobutane
CID 65007473
1-(bromomethyl)-1-(2-ethoxyethoxymethyl)cyclohexane
CID 65001789
1-(bromomethyl)-1-[2-(2-methylpropoxy)ethoxymethyl]cyclohexane
CID 106447437
1-(bromomethyl)-1-(methoxymethyl)cyclobutane
CID 65007363
1-(bromomethyl)-1-(3-methylbut-3-enoxymethyl)cyclopentane
CID 114470059
1-(bromomethyl)-1-(3,3-dimethylbutoxymethyl)cyclohexane
CID 66234060
[1-(2-methoxyethoxymethyl)cycloheptyl]methanesulfonamide
CID 65010433
1-(bromomethyl)-1-(2-cyclopropylethoxymethyl)cyclohexane
CID 106201182
1-(bromomethyl)-1-(2-methylpropoxymethyl)cyclohexane
CID 65001890
1-(2-methoxyethoxymethyl)-1-[1-(2-methoxyethoxymethyl)cyclohexyl]oxycyclohexane
CID 22447736
ethane;1-(2-methoxyethyl)-1-(methoxymethyl)cyclopentane
CID 143807089
1-(bromomethyl)-1-[2-(3-methoxypropoxy)ethyl]cyclobutane
CID 103185009

Frequently Asked Questions

What is the IUPAC name of 1-(bromomethyl)-1-(2-methoxyethoxymethyl)cyclopentane?
The IUPAC name of 1-(bromomethyl)-1-(2-methoxyethoxymethyl)cyclopentane (CID 65001082) is 1-(bromomethyl)-1-(2-methoxyethoxymethyl)cyclopentane.
What is the SMILES notation for 1-(bromomethyl)-1-(2-methoxyethoxymethyl)cyclopentane?
The canonical SMILES for 1-(bromomethyl)-1-(2-methoxyethoxymethyl)cyclopentane is COCCOCC1(CBr)CCCC1.
What is the InChIKey of 1-(bromomethyl)-1-(2-methoxyethoxymethyl)cyclopentane?
The InChIKey is DLROGRZFKAEEQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19BrO2/c1-12-6-7-13-9-10(8-11)4-2-3-5-10/h2-9H2,1H3.
What are the key properties of 1-(bromomethyl)-1-(2-methoxyethoxymethyl)cyclopentane?
1-(bromomethyl)-1-(2-methoxyethoxymethyl)cyclopentane has a molecular weight of 251.16 g/mol, XLogP of 2.60, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(bromomethyl)-1-(2-methoxyethoxymethyl)cyclopentane is sourced from PubChem (CID 65001082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).