(R)-(5-bromo-4-methylthiophen-2-yl)-cyclopentylmethanamine;hydrochloride

C11H17BrClNS — CID 171203283

IUPAC(R)-(5-bromo-4-methylthiophen-2-yl)-cyclopentylmethanamine;hydrochloride
SMILESCc1cc([C@H](N)C2CCCC2)sc1Br.Cl
InChIInChI=1S/C11H16BrNS.ClH/c1-7-6-9(14-11(7)12)10(13)8-4-2-3-5-8;/h6,8,10H,2-5,13H2,1H3;1H/t10-;/m1./s1
InChIKeySFEWPOJPWKULHY-HNCPQSOCSA-N
MW310.69 g/mol
LogP4.43
Rot. Bonds2

About (R)-(5-bromo-4-methylthiophen-2-yl)-cyclopentylmethanamine;hydrochloride

(R)-(5-bromo-4-methylthiophen-2-yl)-cyclopentylmethanamine;hydrochloride (PubChem CID 171203283) has the molecular formula C11H17BrClNS and a molecular weight of 310.69 g/mol. Its IUPAC name is (R)-(5-bromo-4-methylthiophen-2-yl)-cyclopentylmethanamine;hydrochloride.

Molecular Properties

Compound Name(R)-(5-bromo-4-methylthiophen-2-yl)-cyclopentylmethanamine;hydrochloride
PubChem CID171203283
Molecular FormulaC11H17BrClNS
Molecular Weight310.69 g/mol
Exact Mass309.00
IUPAC Name(R)-(5-bromo-4-methylthiophen-2-yl)-cyclopentylmethanamine;hydrochloride
SMILESCc1cc([C@H](N)C2CCCC2)sc1Br.Cl
InChIInChI=1S/C11H16BrNS.ClH/c1-7-6-9(14-11(7)12)10(13)8-4-2-3-5-8;/h6,8,10H,2-5,13H2,1H3;1H/t10-;/m1./s1
InChIKeySFEWPOJPWKULHY-HNCPQSOCSA-N
XLogP4.43
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.69
LogP ≤ 54.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(R)-(5-bromo-4-methylthiophen-2-yl)-cyclohexylmethanamine
CID 171203284
(5-bromo-4-methylthiophen-2-yl)-cyclobutylmethanamine
CID 79996891
(R)-(5-bromo-4-methylthiophen-2-yl)-piperidin-4-ylmethanamine;hydrochloride
CID 171314278
(S)-(5-bromo-4-methylthiophen-2-yl)-(oxan-4-yl)methanamine
CID 131603717
(S)-cyclohexyl-(4,5-dibromothiophen-2-yl)methanamine;hydrochloride
CID 171235188
cyclopentyl-(4,5-dimethylthiophen-2-yl)methanamine
CID 115778964
(5-bromo-4-methylthiophen-2-yl)-(3-methylsulfonylcyclohexyl)methanamine
CID 105014349
cyclobutyl-(4,5-dibromothiophen-2-yl)methanamine
CID 80533020
(5-bromo-4-methylthiophen-2-yl)-cycloheptylmethanol
CID 79991365
(1R)-1-(5-bromo-4-methylthiophen-2-yl)-2-cyclopropylethanamine;hydrochloride
CID 171203275
1-(5-bromo-4-methylthiophen-2-yl)-1-cyclopentyl-N-methylmethanamine
CID 79991112
(1R)-1-(5-bromo-4-methylthiophen-2-yl)-2-cyclopropylethanamine
CID 130055202

Frequently Asked Questions

What is the IUPAC name of (R)-(5-bromo-4-methylthiophen-2-yl)-cyclopentylmethanamine;hydrochloride?
The IUPAC name of (R)-(5-bromo-4-methylthiophen-2-yl)-cyclopentylmethanamine;hydrochloride (CID 171203283) is (R)-(5-bromo-4-methylthiophen-2-yl)-cyclopentylmethanamine;hydrochloride.
What is the SMILES notation for (R)-(5-bromo-4-methylthiophen-2-yl)-cyclopentylmethanamine;hydrochloride?
The canonical SMILES for (R)-(5-bromo-4-methylthiophen-2-yl)-cyclopentylmethanamine;hydrochloride is Cc1cc([C@H](N)C2CCCC2)sc1Br.Cl.
What is the InChIKey of (R)-(5-bromo-4-methylthiophen-2-yl)-cyclopentylmethanamine;hydrochloride?
The InChIKey is SFEWPOJPWKULHY-HNCPQSOCSA-N. The full InChI is InChI=1S/C11H16BrNS.ClH/c1-7-6-9(14-11(7)12)10(13)8-4-2-3-5-8;/h6,8,10H,2-5,13H2,1H3;1H/t10-;/m1./s1.
What are the key properties of (R)-(5-bromo-4-methylthiophen-2-yl)-cyclopentylmethanamine;hydrochloride?
(R)-(5-bromo-4-methylthiophen-2-yl)-cyclopentylmethanamine;hydrochloride has a molecular weight of 310.69 g/mol, XLogP of 4.43, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-(5-bromo-4-methylthiophen-2-yl)-cyclopentylmethanamine;hydrochloride is sourced from PubChem (CID 171203283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).