(R)-(5-bromo-3-pyridinyl)-thiophen-3-ylmethanamine;hydrochloride

C10H10BrClN2S — CID 171218200

IUPAC(R)-(5-bromo-3-pyridinyl)-thiophen-3-ylmethanamine;hydrochloride
SMILESCl.N[C@@H](c1ccsc1)c1cncc(Br)c1
InChIInChI=1S/C10H9BrN2S.ClH/c11-9-3-8(4-13-5-9)10(12)7-1-2-14-6-7;/h1-6,10H,12H2;1H/t10-;/m0./s1
InChIKeyDZCYXOVPMYDJJJ-PPHPATTJSA-N
MW305.63 g/mol
LogP3.38
Rot. Bonds2

About (R)-(5-bromo-3-pyridinyl)-thiophen-3-ylmethanamine;hydrochloride

(R)-(5-bromo-3-pyridinyl)-thiophen-3-ylmethanamine;hydrochloride (PubChem CID 171218200) has the molecular formula C10H10BrClN2S and a molecular weight of 305.63 g/mol. Its IUPAC name is (R)-(5-bromo-3-pyridinyl)-thiophen-3-ylmethanamine;hydrochloride.

Molecular Properties

Compound Name(R)-(5-bromo-3-pyridinyl)-thiophen-3-ylmethanamine;hydrochloride
PubChem CID171218200
Molecular FormulaC10H10BrClN2S
Molecular Weight305.63 g/mol
Exact Mass303.94
IUPAC Name(R)-(5-bromo-3-pyridinyl)-thiophen-3-ylmethanamine;hydrochloride
SMILESCl.N[C@@H](c1ccsc1)c1cncc(Br)c1
InChIInChI=1S/C10H9BrN2S.ClH/c11-9-3-8(4-13-5-9)10(12)7-1-2-14-6-7;/h1-6,10H,12H2;1H/t10-;/m0./s1
InChIKeyDZCYXOVPMYDJJJ-PPHPATTJSA-N
XLogP3.38
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.63
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(R)-(3-bromophenyl)-thiophen-3-ylmethanamine;hydrochloride
CID 171218747
(S)-(3-bromophenyl)-thiophen-3-ylmethanamine
CID 171199224
(S)-(6-bromo-3-pyridinyl)-thiophen-3-ylmethanamine;hydrochloride
CID 171203330
(5-bromo-3-pyridinyl)-(1,2-thiazol-3-yl)methanamine
CID 130943778
(S)-(2-bromo-4-pyridinyl)-thiophen-3-ylmethanamine
CID 171203449
(R)-(3,4-dichlorophenyl)-thiophen-3-ylmethanamine;hydrochloride
CID 171220907
4-[(S)-amino(thiophen-3-yl)methyl]-2,6-dibromophenol
CID 171200005
(S)-(4-bromo-3-fluorophenyl)-thiophen-3-ylmethanamine;hydrochloride
CID 171201796
1-(5-bromo-3-pyridinyl)ethanamine;dihydrochloride
CID 138110830
(R)-(5-bromo-2-fluorophenyl)-thiophen-3-ylmethanamine;hydrochloride
CID 171220162
(S)-(3-bromo-4-methoxyphenyl)-thiophen-3-ylmethanamine;hydrochloride
CID 171205925
(R)-(3,4-difluorophenyl)-thiophen-3-ylmethanamine;hydrochloride
CID 171229652

Frequently Asked Questions

What is the IUPAC name of (R)-(5-bromo-3-pyridinyl)-thiophen-3-ylmethanamine;hydrochloride?
The IUPAC name of (R)-(5-bromo-3-pyridinyl)-thiophen-3-ylmethanamine;hydrochloride (CID 171218200) is (R)-(5-bromo-3-pyridinyl)-thiophen-3-ylmethanamine;hydrochloride.
What is the SMILES notation for (R)-(5-bromo-3-pyridinyl)-thiophen-3-ylmethanamine;hydrochloride?
The canonical SMILES for (R)-(5-bromo-3-pyridinyl)-thiophen-3-ylmethanamine;hydrochloride is Cl.N[C@@H](c1ccsc1)c1cncc(Br)c1.
What is the InChIKey of (R)-(5-bromo-3-pyridinyl)-thiophen-3-ylmethanamine;hydrochloride?
The InChIKey is DZCYXOVPMYDJJJ-PPHPATTJSA-N. The full InChI is InChI=1S/C10H9BrN2S.ClH/c11-9-3-8(4-13-5-9)10(12)7-1-2-14-6-7;/h1-6,10H,12H2;1H/t10-;/m0./s1.
What are the key properties of (R)-(5-bromo-3-pyridinyl)-thiophen-3-ylmethanamine;hydrochloride?
(R)-(5-bromo-3-pyridinyl)-thiophen-3-ylmethanamine;hydrochloride has a molecular weight of 305.63 g/mol, XLogP of 3.38, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-(5-bromo-3-pyridinyl)-thiophen-3-ylmethanamine;hydrochloride is sourced from PubChem (CID 171218200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).