8-(bromomethyl)-2-methyl-2-azaspiro[4.5]decane

C11H20BrN — CID 71647915

IUPAC8-(bromomethyl)-2-methyl-2-azaspiro[4.5]decane
SMILESCN1CCC2(CCC(CBr)CC2)C1
InChIInChI=1S/C11H20BrN/c1-13-7-6-11(9-13)4-2-10(8-12)3-5-11/h10H,2-9H2,1H3
InChIKeyGYEBZPFASVGECF-UHFFFAOYSA-N
MW246.19 g/mol
LogP2.89
Rot. Bonds1

About 8-(bromomethyl)-2-methyl-2-azaspiro[4.5]decane

8-(bromomethyl)-2-methyl-2-azaspiro[4.5]decane (PubChem CID 71647915) has the molecular formula C11H20BrN and a molecular weight of 246.19 g/mol. Its IUPAC name is 8-(bromomethyl)-2-methyl-2-azaspiro[4.5]decane.

Molecular Properties

Compound Name8-(bromomethyl)-2-methyl-2-azaspiro[4.5]decane
PubChem CID71647915
Molecular FormulaC11H20BrN
Molecular Weight246.19 g/mol
Exact Mass245.08
IUPAC Name8-(bromomethyl)-2-methyl-2-azaspiro[4.5]decane
SMILESCN1CCC2(CCC(CBr)CC2)C1
InChIInChI=1S/C11H20BrN/c1-13-7-6-11(9-13)4-2-10(8-12)3-5-11/h10H,2-9H2,1H3
InChIKeyGYEBZPFASVGECF-UHFFFAOYSA-N
XLogP2.89
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.19
LogP ≤ 52.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2,7-dimethyl-2,7-diazaspiro[4.4]nonane;ethane
CID 144510455
2,7-dimethyl-2,7-diazaspiro[3.4]octane;ethane
CID 143122018
2-methyl-2-azaspiro[4.4]nonane
CID 59284550
1-[8-(bromomethyl)-2-azaspiro[4.5]decan-2-yl]-2-chloroethanone
CID 71646498
(5R,8R)-8-(bromomethyl)-2-propan-2-yl-2-azaspiro[4.4]nonane
CID 98083969
2-[(5R,8R)-8-(bromomethyl)-2-azaspiro[4.4]nonan-2-yl]ethanamine
CID 97168987
9-(cyclopropylmethyl)-2-methyl-2,9-diazaspiro[5.5]undecane
CID 171845215
ethane;2-methyl-8-propan-2-yl-2,8-diazaspiro[4.5]decane
CID 177025738
CID 176992931
CID 176992931
ethane;7-methyl-2-oxa-7-azaspiro[3.4]octane
CID 145338832
6-methyl-2-(methylsulfanylmethyl)-6-azaspiro[3.4]octane
CID 146488492
2-(2-methyl-2,8-diazaspiro[4.5]decan-8-yl)ethanol
CID 71647927

Frequently Asked Questions

What is the IUPAC name of 8-(bromomethyl)-2-methyl-2-azaspiro[4.5]decane?
The IUPAC name of 8-(bromomethyl)-2-methyl-2-azaspiro[4.5]decane (CID 71647915) is 8-(bromomethyl)-2-methyl-2-azaspiro[4.5]decane.
What is the SMILES notation for 8-(bromomethyl)-2-methyl-2-azaspiro[4.5]decane?
The canonical SMILES for 8-(bromomethyl)-2-methyl-2-azaspiro[4.5]decane is CN1CCC2(CCC(CBr)CC2)C1.
What is the InChIKey of 8-(bromomethyl)-2-methyl-2-azaspiro[4.5]decane?
The InChIKey is GYEBZPFASVGECF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20BrN/c1-13-7-6-11(9-13)4-2-10(8-12)3-5-11/h10H,2-9H2,1H3.
What are the key properties of 8-(bromomethyl)-2-methyl-2-azaspiro[4.5]decane?
8-(bromomethyl)-2-methyl-2-azaspiro[4.5]decane has a molecular weight of 246.19 g/mol, XLogP of 2.89, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(bromomethyl)-2-methyl-2-azaspiro[4.5]decane is sourced from PubChem (CID 71647915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).