(S)-(5-bromothiophen-2-yl)-cyclopentylmethanamine;hydrochloride

C10H15BrClNS — CID 171222527

IUPAC(S)-(5-bromothiophen-2-yl)-cyclopentylmethanamine;hydrochloride
SMILESCl.N[C@H](c1ccc(Br)s1)C1CCCC1
InChIInChI=1S/C10H14BrNS.ClH/c11-9-6-5-8(13-9)10(12)7-3-1-2-4-7;/h5-7,10H,1-4,12H2;1H/t10-;/m0./s1
InChIKeySXWDPPJYUXOEFW-PPHPATTJSA-N
MW296.66 g/mol
LogP4.12
Rot. Bonds2

About (S)-(5-bromothiophen-2-yl)-cyclopentylmethanamine;hydrochloride

(S)-(5-bromothiophen-2-yl)-cyclopentylmethanamine;hydrochloride (PubChem CID 171222527) has the molecular formula C10H15BrClNS and a molecular weight of 296.66 g/mol. Its IUPAC name is (S)-(5-bromothiophen-2-yl)-cyclopentylmethanamine;hydrochloride.

Molecular Properties

Compound Name(S)-(5-bromothiophen-2-yl)-cyclopentylmethanamine;hydrochloride
PubChem CID171222527
Molecular FormulaC10H15BrClNS
Molecular Weight296.66 g/mol
Exact Mass294.98
IUPAC Name(S)-(5-bromothiophen-2-yl)-cyclopentylmethanamine;hydrochloride
SMILESCl.N[C@H](c1ccc(Br)s1)C1CCCC1
InChIInChI=1S/C10H14BrNS.ClH/c11-9-6-5-8(13-9)10(12)7-3-1-2-4-7;/h5-7,10H,1-4,12H2;1H/t10-;/m0./s1
InChIKeySXWDPPJYUXOEFW-PPHPATTJSA-N
XLogP4.12
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.66
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(S)-(5-bromothiophen-2-yl)-(oxan-4-yl)methanamine;hydrochloride
CID 171240660
(5-bromothiophen-2-yl)-(1,1-dioxothian-4-yl)methanamine
CID 116821436
(5-bromothiophen-2-yl)-(4-tert-butylcyclohexyl)methanamine
CID 63501690
4-[amino-(5-bromothiophen-2-yl)methyl]cyclohexane-1-carboxylic acid
CID 116938801
(R)-(5-chlorothiophen-2-yl)-cyclobutylmethanamine;hydrochloride
CID 171200582
(R)-cyclopentyl-(5-ethylthiophen-2-yl)methanamine;hydrochloride
CID 171211749
(S)-cyclohexyl-(4,5-dibromothiophen-2-yl)methanamine;hydrochloride
CID 171235188
(5-bromothiophen-2-yl)-(1-oxaspiro[5.5]undecan-4-yl)methanamine
CID 79915556
(1S)-N-[1-(5-bromothiophen-2-yl)ethyl]-1-cyclohexylethanamine
CID 81386958
(R)-(5-bromo-4-methylthiophen-2-yl)-cyclopentylmethanamine;hydrochloride
CID 171203283
cycloheptyl-(5-ethylthiophen-2-yl)methanamine
CID 62587234
1-(5-bromothiophen-2-yl)-3-cyclopentylpropan-1-amine
CID 61103011

Frequently Asked Questions

What is the IUPAC name of (S)-(5-bromothiophen-2-yl)-cyclopentylmethanamine;hydrochloride?
The IUPAC name of (S)-(5-bromothiophen-2-yl)-cyclopentylmethanamine;hydrochloride (CID 171222527) is (S)-(5-bromothiophen-2-yl)-cyclopentylmethanamine;hydrochloride.
What is the SMILES notation for (S)-(5-bromothiophen-2-yl)-cyclopentylmethanamine;hydrochloride?
The canonical SMILES for (S)-(5-bromothiophen-2-yl)-cyclopentylmethanamine;hydrochloride is Cl.N[C@H](c1ccc(Br)s1)C1CCCC1.
What is the InChIKey of (S)-(5-bromothiophen-2-yl)-cyclopentylmethanamine;hydrochloride?
The InChIKey is SXWDPPJYUXOEFW-PPHPATTJSA-N. The full InChI is InChI=1S/C10H14BrNS.ClH/c11-9-6-5-8(13-9)10(12)7-3-1-2-4-7;/h5-7,10H,1-4,12H2;1H/t10-;/m0./s1.
What are the key properties of (S)-(5-bromothiophen-2-yl)-cyclopentylmethanamine;hydrochloride?
(S)-(5-bromothiophen-2-yl)-cyclopentylmethanamine;hydrochloride has a molecular weight of 296.66 g/mol, XLogP of 4.12, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (S)-(5-bromothiophen-2-yl)-cyclopentylmethanamine;hydrochloride is sourced from PubChem (CID 171222527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).