(5-bromothiophen-2-yl)-(5-methylthiophen-3-yl)methanamine

C10H10BrNS2 — CID 65104934

IUPAC(5-bromothiophen-2-yl)-(5-methylthiophen-3-yl)methanamine
SMILESCc1cc(C(N)c2ccc(Br)s2)cs1
InChIInChI=1S/C10H10BrNS2/c1-6-4-7(5-13-6)10(12)8-2-3-9(11)14-8/h2-5,10H,12H2,1H3
InChIKeyOXXJVPGTQJUCMF-UHFFFAOYSA-N
MW288.24 g/mol
LogP3.93
Rot. Bonds2

About (5-bromothiophen-2-yl)-(5-methylthiophen-3-yl)methanamine

(5-bromothiophen-2-yl)-(5-methylthiophen-3-yl)methanamine (PubChem CID 65104934) has the molecular formula C10H10BrNS2 and a molecular weight of 288.24 g/mol. Its IUPAC name is (5-bromothiophen-2-yl)-(5-methylthiophen-3-yl)methanamine.

Molecular Properties

Compound Name(5-bromothiophen-2-yl)-(5-methylthiophen-3-yl)methanamine
PubChem CID65104934
Molecular FormulaC10H10BrNS2
Molecular Weight288.24 g/mol
Exact Mass286.94
IUPAC Name(5-bromothiophen-2-yl)-(5-methylthiophen-3-yl)methanamine
SMILESCc1cc(C(N)c2ccc(Br)s2)cs1
InChIInChI=1S/C10H10BrNS2/c1-6-4-7(5-13-6)10(12)8-2-3-9(11)14-8/h2-5,10H,12H2,1H3
InChIKeyOXXJVPGTQJUCMF-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

(4-bromothiophen-2-yl)-(5-methylthiophen-3-yl)methanamine
CID 65105046
(5-bromothiophen-2-yl)-(3-methylphenyl)methanamine
CID 61102439
(4-bromothiophen-3-yl)-(5-methylthiophen-3-yl)methanamine
CID 130993276
(4-bromo-3,5-dimethylphenyl)-(5-methylthiophen-3-yl)methanamine
CID 114330142
(5-bromothiophen-2-yl)-thiophen-3-ylmethanamine
CID 61102813
(2-bromo-5-methylphenyl)-(5-methylthiophen-3-yl)methanamine
CID 104991668
(5-methylthiophen-3-yl)-(4-propan-2-ylphenyl)methanamine
CID 65105067
(4-methyl-1,3-thiazol-2-yl)-(5-methylthiophen-3-yl)methanamine
CID 130731435
(5-bromothiophen-2-yl)-(4-fluoro-2,6-dimethylphenyl)methanamine
CID 106877134
(3-bromo-5-chlorophenyl)-(5-bromothiophen-2-yl)methanamine
CID 107950502
(5-bromofuran-3-yl)-(5-methylthiophen-3-yl)methanamine
CID 130747012
6-[amino-(5-bromothiophen-2-yl)methyl]-1,4-dihydroquinoxaline-2,3-dione
CID 43464018

Frequently Asked Questions

What is the IUPAC name of (5-bromothiophen-2-yl)-(5-methylthiophen-3-yl)methanamine?
The IUPAC name of (5-bromothiophen-2-yl)-(5-methylthiophen-3-yl)methanamine (CID 65104934) is (5-bromothiophen-2-yl)-(5-methylthiophen-3-yl)methanamine.
What is the SMILES notation for (5-bromothiophen-2-yl)-(5-methylthiophen-3-yl)methanamine?
The canonical SMILES for (5-bromothiophen-2-yl)-(5-methylthiophen-3-yl)methanamine is Cc1cc(C(N)c2ccc(Br)s2)cs1.
What is the InChIKey of (5-bromothiophen-2-yl)-(5-methylthiophen-3-yl)methanamine?
The InChIKey is OXXJVPGTQJUCMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10BrNS2/c1-6-4-7(5-13-6)10(12)8-2-3-9(11)14-8/h2-5,10H,12H2,1H3.
What are the key properties of (5-bromothiophen-2-yl)-(5-methylthiophen-3-yl)methanamine?
(5-bromothiophen-2-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 (5-bromothiophen-2-yl)-(5-methylthiophen-3-yl)methanamine is sourced from PubChem (CID 65104934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).