(2,5-dibromothiophen-3-yl)-(3-methylthiophen-2-yl)methanamine

C10H9Br2NS2 — CID 43464814

IUPAC(2,5-dibromothiophen-3-yl)-(3-methylthiophen-2-yl)methanamine
SMILESCc1ccsc1C(N)c1cc(Br)sc1Br
InChIInChI=1S/C10H9Br2NS2/c1-5-2-3-14-9(5)8(13)6-4-7(11)15-10(6)12/h2-4,8H,13H2,1H3
InChIKeyLYACLEKRXRTZDD-UHFFFAOYSA-N
MW367.13 g/mol
LogP4.69
Rot. Bonds2

About (2,5-dibromothiophen-3-yl)-(3-methylthiophen-2-yl)methanamine

(2,5-dibromothiophen-3-yl)-(3-methylthiophen-2-yl)methanamine (PubChem CID 43464814) has the molecular formula C10H9Br2NS2 and a molecular weight of 367.13 g/mol. Its IUPAC name is (2,5-dibromothiophen-3-yl)-(3-methylthiophen-2-yl)methanamine.

Molecular Properties

Compound Name(2,5-dibromothiophen-3-yl)-(3-methylthiophen-2-yl)methanamine
PubChem CID43464814
Molecular FormulaC10H9Br2NS2
Molecular Weight367.13 g/mol
Exact Mass364.85
IUPAC Name(2,5-dibromothiophen-3-yl)-(3-methylthiophen-2-yl)methanamine
SMILESCc1ccsc1C(N)c1cc(Br)sc1Br
InChIInChI=1S/C10H9Br2NS2/c1-5-2-3-14-9(5)8(13)6-4-7(11)15-10(6)12/h2-4,8H,13H2,1H3
InChIKeyLYACLEKRXRTZDD-UHFFFAOYSA-N
XLogP4.69
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.13
LogP ≤ 54.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3-bromo-5-methylthiophen-2-yl)-(3-methylthiophen-2-yl)methanamine
CID 65279285
(5-bromo-2-methylthiophen-3-yl)-(2,5-dibromothiophen-3-yl)methanamine
CID 107961099
(3-methylthiophen-2-yl)-(2,3,5,6-tetramethylphenyl)methanamine
CID 43384383
(2,4-difluorophenyl)-(3-methylthiophen-2-yl)methanamine
CID 43464212
2,5-dibromo-3-[(3-bromothiophen-2-yl)-chloromethyl]thiophene
CID 63796992
2-(3-bromothiophen-2-yl)-1-(2,5-dibromothiophen-3-yl)ethanamine
CID 107968208
[(2,5-dibromothiophen-3-yl)-(2-methylthiophen-3-yl)methyl]hydrazine
CID 107970684
(2-methoxy-5-methylphenyl)-(3-methylthiophen-2-yl)methanamine
CID 43626117
(2,5-dibromothiophen-3-yl)-(3-methylphenyl)methanamine
CID 43345006
(3,5-dibromophenyl)-(2,5-dibromothiophen-3-yl)methanamine
CID 114023500
(3-bromofuran-2-yl)-(3-methylthiophen-2-yl)methanamine
CID 115861576
(3-chloro-2-methylphenyl)-(2,5-dibromothiophen-3-yl)methanamine
CID 107096356

Frequently Asked Questions

What is the IUPAC name of (2,5-dibromothiophen-3-yl)-(3-methylthiophen-2-yl)methanamine?
The IUPAC name of (2,5-dibromothiophen-3-yl)-(3-methylthiophen-2-yl)methanamine (CID 43464814) is (2,5-dibromothiophen-3-yl)-(3-methylthiophen-2-yl)methanamine.
What is the SMILES notation for (2,5-dibromothiophen-3-yl)-(3-methylthiophen-2-yl)methanamine?
The canonical SMILES for (2,5-dibromothiophen-3-yl)-(3-methylthiophen-2-yl)methanamine is Cc1ccsc1C(N)c1cc(Br)sc1Br.
What is the InChIKey of (2,5-dibromothiophen-3-yl)-(3-methylthiophen-2-yl)methanamine?
The InChIKey is LYACLEKRXRTZDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9Br2NS2/c1-5-2-3-14-9(5)8(13)6-4-7(11)15-10(6)12/h2-4,8H,13H2,1H3.
What are the key properties of (2,5-dibromothiophen-3-yl)-(3-methylthiophen-2-yl)methanamine?
(2,5-dibromothiophen-3-yl)-(3-methylthiophen-2-yl)methanamine has a molecular weight of 367.13 g/mol, XLogP of 4.69, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-dibromothiophen-3-yl)-(3-methylthiophen-2-yl)methanamine is sourced from PubChem (CID 43464814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).