1-cyclopentyl-1-(2,5-dibromothiophen-3-yl)-N-methylmethanamine

C11H15Br2NS — CID 43486979

IUPAC1-cyclopentyl-1-(2,5-dibromothiophen-3-yl)-N-methylmethanamine
SMILESCNC(c1cc(Br)sc1Br)C1CCCC1
InChIInChI=1S/C11H15Br2NS/c1-14-10(7-4-2-3-5-7)8-6-9(12)15-11(8)13/h6-7,10,14H,2-5H2,1H3
InChIKeyVEKGYFHBMGBASU-UHFFFAOYSA-N
MW353.12 g/mol
LogP4.72
Rot. Bonds3

About 1-cyclopentyl-1-(2,5-dibromothiophen-3-yl)-N-methylmethanamine

1-cyclopentyl-1-(2,5-dibromothiophen-3-yl)-N-methylmethanamine (PubChem CID 43486979) has the molecular formula C11H15Br2NS and a molecular weight of 353.12 g/mol. Its IUPAC name is 1-cyclopentyl-1-(2,5-dibromothiophen-3-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-cyclopentyl-1-(2,5-dibromothiophen-3-yl)-N-methylmethanamine
PubChem CID43486979
Molecular FormulaC11H15Br2NS
Molecular Weight353.12 g/mol
Exact Mass350.93
IUPAC Name1-cyclopentyl-1-(2,5-dibromothiophen-3-yl)-N-methylmethanamine
SMILESCNC(c1cc(Br)sc1Br)C1CCCC1
InChIInChI=1S/C11H15Br2NS/c1-14-10(7-4-2-3-5-7)8-6-9(12)15-11(8)13/h6-7,10,14H,2-5H2,1H3
InChIKeyVEKGYFHBMGBASU-UHFFFAOYSA-N
XLogP4.72
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.12
LogP ≤ 54.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(5-bromo-4-methylthiophen-2-yl)-1-cyclopentyl-N-methylmethanamine
CID 79991112
1-(5-bromo-4-chlorothiophen-2-yl)-1-cyclooctyl-N-methylmethanamine
CID 80531200
1-(2-bromo-4-chlorophenyl)-1-cyclopentyl-N-methylmethanamine
CID 107991787
1-(3-bromo-2-methylphenyl)-1-cyclohexyl-N-methylmethanamine
CID 114980961
1-(4-bromo-2-methylphenyl)-1-cyclohexyl-N-methylmethanamine
CID 114980955
2-cyclohexyl-1-(2,5-dibromothiophen-3-yl)-N-ethylethanamine
CID 43493192
(2,5-dibromothiophen-3-yl)-(3-methylcyclohexyl)methanol
CID 107969704
1-(3-bromo-2-chlorophenyl)-1-cyclohexyl-N-methylmethanamine
CID 114981468
1-(2-bromo-4,5-dimethoxyphenyl)-1-cycloheptyl-N-methylmethanamine
CID 63509267
1-(2-bromo-4-fluorophenyl)-1-cycloheptyl-N-methylmethanamine
CID 105027896
1-cyclopentyl-N-methyl-1-(2-methylthiophen-3-yl)methanamine
CID 102832026
1-cycloheptyl-N-methyl-1-(4-methylthiophen-3-yl)methanamine
CID 82932611

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-1-(2,5-dibromothiophen-3-yl)-N-methylmethanamine?
The IUPAC name of 1-cyclopentyl-1-(2,5-dibromothiophen-3-yl)-N-methylmethanamine (CID 43486979) is 1-cyclopentyl-1-(2,5-dibromothiophen-3-yl)-N-methylmethanamine.
What is the SMILES notation for 1-cyclopentyl-1-(2,5-dibromothiophen-3-yl)-N-methylmethanamine?
The canonical SMILES for 1-cyclopentyl-1-(2,5-dibromothiophen-3-yl)-N-methylmethanamine is CNC(c1cc(Br)sc1Br)C1CCCC1.
What is the InChIKey of 1-cyclopentyl-1-(2,5-dibromothiophen-3-yl)-N-methylmethanamine?
The InChIKey is VEKGYFHBMGBASU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15Br2NS/c1-14-10(7-4-2-3-5-7)8-6-9(12)15-11(8)13/h6-7,10,14H,2-5H2,1H3.
What are the key properties of 1-cyclopentyl-1-(2,5-dibromothiophen-3-yl)-N-methylmethanamine?
1-cyclopentyl-1-(2,5-dibromothiophen-3-yl)-N-methylmethanamine has a molecular weight of 353.12 g/mol, XLogP of 4.72, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-1-(2,5-dibromothiophen-3-yl)-N-methylmethanamine is sourced from PubChem (CID 43486979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).