(4-bromothiophen-3-yl)-(5-methylthiophen-3-yl)methanamine

C10H10BrNS2 — CID 130993276

IUPAC(4-bromothiophen-3-yl)-(5-methylthiophen-3-yl)methanamine
SMILESCc1cc(C(N)c2cscc2Br)cs1
InChIInChI=1S/C10H10BrNS2/c1-6-2-7(3-14-6)10(12)8-4-13-5-9(8)11/h2-5,10H,12H2,1H3
InChIKeySUDXMKGYFJPBOB-UHFFFAOYSA-N
MW288.24 g/mol
LogP3.93
Rot. Bonds2

About (4-bromothiophen-3-yl)-(5-methylthiophen-3-yl)methanamine

(4-bromothiophen-3-yl)-(5-methylthiophen-3-yl)methanamine (PubChem CID 130993276) has the molecular formula C10H10BrNS2 and a molecular weight of 288.24 g/mol. Its IUPAC name is (4-bromothiophen-3-yl)-(5-methylthiophen-3-yl)methanamine.

Molecular Properties

Compound Name(4-bromothiophen-3-yl)-(5-methylthiophen-3-yl)methanamine
PubChem CID130993276
Molecular FormulaC10H10BrNS2
Molecular Weight288.24 g/mol
Exact Mass286.94
IUPAC Name(4-bromothiophen-3-yl)-(5-methylthiophen-3-yl)methanamine
SMILESCc1cc(C(N)c2cscc2Br)cs1
InChIInChI=1S/C10H10BrNS2/c1-6-2-7(3-14-6)10(12)8-4-13-5-9(8)11/h2-5,10H,12H2,1H3
InChIKeySUDXMKGYFJPBOB-UHFFFAOYSA-N
XLogP3.93
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.24
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2-bromo-5-methylphenyl)-(5-methylthiophen-3-yl)methanamine
CID 104991668
(4-bromothiophen-3-yl)-(4-methylphenyl)methanamine
CID 79594983
(4-bromothiophen-2-yl)-(5-methylthiophen-3-yl)methanamine
CID 65105046
(5-bromothiophen-2-yl)-(5-methylthiophen-3-yl)methanamine
CID 65104934
(4-bromo-3,5-dimethylphenyl)-(5-methylthiophen-3-yl)methanamine
CID 114330142
(4-methyl-1,3-thiazol-2-yl)-(5-methylthiophen-3-yl)methanamine
CID 130731435
(4-bromothiophen-3-yl)-(4,5-dimethylthiophen-2-yl)methanamine
CID 105010852
(4-bromothiophen-3-yl)-(4-methoxyphenyl)methanamine
CID 79595197
(5-bromofuran-3-yl)-(5-methylthiophen-3-yl)methanamine
CID 130747012
(4-bromothiophen-3-yl)-(2-methylphenyl)methanamine
CID 79596069
(2-chloro-4-methylphenyl)-(5-methylthiophen-3-yl)methanamine
CID 106857827
(2-methoxyphenyl)-(5-methylthiophen-3-yl)methanamine
CID 65104269

Frequently Asked Questions

What is the IUPAC name of (4-bromothiophen-3-yl)-(5-methylthiophen-3-yl)methanamine?
The IUPAC name of (4-bromothiophen-3-yl)-(5-methylthiophen-3-yl)methanamine (CID 130993276) is (4-bromothiophen-3-yl)-(5-methylthiophen-3-yl)methanamine.
What is the SMILES notation for (4-bromothiophen-3-yl)-(5-methylthiophen-3-yl)methanamine?
The canonical SMILES for (4-bromothiophen-3-yl)-(5-methylthiophen-3-yl)methanamine is Cc1cc(C(N)c2cscc2Br)cs1.
What is the InChIKey of (4-bromothiophen-3-yl)-(5-methylthiophen-3-yl)methanamine?
The InChIKey is SUDXMKGYFJPBOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10BrNS2/c1-6-2-7(3-14-6)10(12)8-4-13-5-9(8)11/h2-5,10H,12H2,1H3.
What are the key properties of (4-bromothiophen-3-yl)-(5-methylthiophen-3-yl)methanamine?
(4-bromothiophen-3-yl)-(5-methylthiophen-3-yl)methanamine has a molecular weight of 288.24 g/mol, XLogP of 3.93, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-bromothiophen-3-yl)-(5-methylthiophen-3-yl)methanamine is sourced from PubChem (CID 130993276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).