(R)-(3-bromothiophen-2-yl)-thiophen-2-ylmethanamine;hydrochloride

C9H9BrClNS2 — CID 171211028

IUPAC(R)-(3-bromothiophen-2-yl)-thiophen-2-ylmethanamine;hydrochloride
SMILESCl.N[C@H](c1cccs1)c1sccc1Br
InChIInChI=1S/C9H8BrNS2.ClH/c10-6-3-5-13-9(6)8(11)7-2-1-4-12-7;/h1-5,8H,11H2;1H/t8-;/m1./s1
InChIKeyHXCQLQWQZGSROV-DDWIOCJRSA-N
MW310.67 g/mol
LogP4.04
Rot. Bonds2

About (R)-(3-bromothiophen-2-yl)-thiophen-2-ylmethanamine;hydrochloride

(R)-(3-bromothiophen-2-yl)-thiophen-2-ylmethanamine;hydrochloride (PubChem CID 171211028) has the molecular formula C9H9BrClNS2 and a molecular weight of 310.67 g/mol. Its IUPAC name is (R)-(3-bromothiophen-2-yl)-thiophen-2-ylmethanamine;hydrochloride.

Molecular Properties

Compound Name(R)-(3-bromothiophen-2-yl)-thiophen-2-ylmethanamine;hydrochloride
PubChem CID171211028
Molecular FormulaC9H9BrClNS2
Molecular Weight310.67 g/mol
Exact Mass308.90
IUPAC Name(R)-(3-bromothiophen-2-yl)-thiophen-2-ylmethanamine;hydrochloride
SMILESCl.N[C@H](c1cccs1)c1sccc1Br
InChIInChI=1S/C9H8BrNS2.ClH/c10-6-3-5-13-9(6)8(11)7-2-1-4-12-7;/h1-5,8H,11H2;1H/t8-;/m1./s1
InChIKeyHXCQLQWQZGSROV-DDWIOCJRSA-N
XLogP4.04
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.67
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3-bromothiophen-2-yl)-(5-bromothiophen-2-yl)methanamine
CID 63798269
dithiophen-2-ylmethanamine;hydroiodide
CID 175262247
(3-bromothiophen-2-yl)-(2,6-dichlorophenyl)methanamine
CID 80534984
(5-bromo-4-chlorothiophen-2-yl)-(3-bromothiophen-2-yl)methanamine
CID 80530685
1-[(S)-(3-bromothiophen-2-yl)-thiophen-2-ylmethyl]piperazine;dihydrochloride
CID 171281047
(R)-(2-bromo-6-fluorophenyl)-thiophen-2-ylmethanamine;hydrochloride
CID 171223227
(3-bromothiophen-2-yl)-(4-bromothiophen-3-yl)methanamine
CID 105010950
(3-bromothiophen-2-yl)-(4-propan-2-ylphenyl)methanamine
CID 63796873
(1S)-1-(3-bromothiophen-2-yl)-2-methylpropan-1-amine
CID 131098099
(3,5-dibromophenyl)-thiophen-2-ylmethanamine
CID 107973859
(1R)-1-(3-bromothiophen-2-yl)prop-2-en-1-amine;hydrochloride
CID 171211010
(3-bromothiophen-2-yl)-(2-methylpyrimidin-4-yl)methanamine
CID 115530329

Frequently Asked Questions

What is the IUPAC name of (R)-(3-bromothiophen-2-yl)-thiophen-2-ylmethanamine;hydrochloride?
The IUPAC name of (R)-(3-bromothiophen-2-yl)-thiophen-2-ylmethanamine;hydrochloride (CID 171211028) is (R)-(3-bromothiophen-2-yl)-thiophen-2-ylmethanamine;hydrochloride.
What is the SMILES notation for (R)-(3-bromothiophen-2-yl)-thiophen-2-ylmethanamine;hydrochloride?
The canonical SMILES for (R)-(3-bromothiophen-2-yl)-thiophen-2-ylmethanamine;hydrochloride is Cl.N[C@H](c1cccs1)c1sccc1Br.
What is the InChIKey of (R)-(3-bromothiophen-2-yl)-thiophen-2-ylmethanamine;hydrochloride?
The InChIKey is HXCQLQWQZGSROV-DDWIOCJRSA-N. The full InChI is InChI=1S/C9H8BrNS2.ClH/c10-6-3-5-13-9(6)8(11)7-2-1-4-12-7;/h1-5,8H,11H2;1H/t8-;/m1./s1.
What are the key properties of (R)-(3-bromothiophen-2-yl)-thiophen-2-ylmethanamine;hydrochloride?
(R)-(3-bromothiophen-2-yl)-thiophen-2-ylmethanamine;hydrochloride has a molecular weight of 310.67 g/mol, XLogP of 4.04, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-(3-bromothiophen-2-yl)-thiophen-2-ylmethanamine;hydrochloride is sourced from PubChem (CID 171211028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).