(1R)-1-(5-bromo-4-methylthiophen-2-yl)-2-cyclopropylethanamine

C10H14BrNS — CID 130055202

IUPAC(1R)-1-(5-bromo-4-methylthiophen-2-yl)-2-cyclopropylethanamine
SMILESCc1cc([C@H](N)CC2CC2)sc1Br
InChIInChI=1S/C10H14BrNS/c1-6-4-9(13-10(6)11)8(12)5-7-2-3-7/h4,7-8H,2-3,5,12H2,1H3/t8-/m1/s1
InChIKeyBLGQXIJPFLASNK-MRVPVSSYSA-N
MW260.20 g/mol
LogP3.62
Rot. Bonds3

About (1R)-1-(5-bromo-4-methylthiophen-2-yl)-2-cyclopropylethanamine

(1R)-1-(5-bromo-4-methylthiophen-2-yl)-2-cyclopropylethanamine (PubChem CID 130055202) has the molecular formula C10H14BrNS and a molecular weight of 260.20 g/mol. Its IUPAC name is (1R)-1-(5-bromo-4-methylthiophen-2-yl)-2-cyclopropylethanamine.

Molecular Properties

Compound Name(1R)-1-(5-bromo-4-methylthiophen-2-yl)-2-cyclopropylethanamine
PubChem CID130055202
Molecular FormulaC10H14BrNS
Molecular Weight260.20 g/mol
Exact Mass259.00
IUPAC Name(1R)-1-(5-bromo-4-methylthiophen-2-yl)-2-cyclopropylethanamine
SMILESCc1cc([C@H](N)CC2CC2)sc1Br
InChIInChI=1S/C10H14BrNS/c1-6-4-9(13-10(6)11)8(12)5-7-2-3-7/h4,7-8H,2-3,5,12H2,1H3/t8-/m1/s1
InChIKeyBLGQXIJPFLASNK-MRVPVSSYSA-N
XLogP3.62
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.20
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1R)-1-(5-bromo-4-methylthiophen-2-yl)-2-cyclopropylethanamine;hydrochloride
CID 171203275
1-(5-bromo-4-methylthiophen-2-yl)-3-cyclopentylpropan-1-amine
CID 79992064
(1R)-1-(5-bromo-4-methylthiophen-2-yl)-3,3-difluoropropan-1-amine
CID 171313610
2-cycloheptyl-1-(4,5-dibromothiophen-2-yl)ethanamine
CID 114457744
(5-bromo-4-methylthiophen-2-yl)-cyclobutylmethanamine
CID 79996891
1-(5-bromo-4-chlorothiophen-2-yl)-2-cyclopentylethanamine
CID 80530689
(R)-(5-bromo-4-methylthiophen-2-yl)-cyclopentylmethanamine;hydrochloride
CID 171203283
(R)-(5-bromo-4-methylthiophen-2-yl)-cyclohexylmethanamine
CID 171203284
1-(5-bromo-4-methylthiophen-2-yl)-2-propan-2-yloxyethanamine
CID 105013420
(S)-(5-bromo-4-methylthiophen-2-yl)-(oxan-4-yl)methanamine
CID 131603717
1-(5-bromo-4-methylthiophen-2-yl)-3,3,3-trifluoropropan-1-amine
CID 79990885
1-(5-bromo-4-methylthiophen-2-yl)-3-(oxan-2-yl)propan-1-amine
CID 79991199

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(5-bromo-4-methylthiophen-2-yl)-2-cyclopropylethanamine?
The IUPAC name of (1R)-1-(5-bromo-4-methylthiophen-2-yl)-2-cyclopropylethanamine (CID 130055202) is (1R)-1-(5-bromo-4-methylthiophen-2-yl)-2-cyclopropylethanamine.
What is the SMILES notation for (1R)-1-(5-bromo-4-methylthiophen-2-yl)-2-cyclopropylethanamine?
The canonical SMILES for (1R)-1-(5-bromo-4-methylthiophen-2-yl)-2-cyclopropylethanamine is Cc1cc([C@H](N)CC2CC2)sc1Br.
What is the InChIKey of (1R)-1-(5-bromo-4-methylthiophen-2-yl)-2-cyclopropylethanamine?
The InChIKey is BLGQXIJPFLASNK-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H14BrNS/c1-6-4-9(13-10(6)11)8(12)5-7-2-3-7/h4,7-8H,2-3,5,12H2,1H3/t8-/m1/s1.
What are the key properties of (1R)-1-(5-bromo-4-methylthiophen-2-yl)-2-cyclopropylethanamine?
(1R)-1-(5-bromo-4-methylthiophen-2-yl)-2-cyclopropylethanamine has a molecular weight of 260.20 g/mol, XLogP of 3.62, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(5-bromo-4-methylthiophen-2-yl)-2-cyclopropylethanamine is sourced from PubChem (CID 130055202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).