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

C9H7Br2NS2 — CID 63798269

IUPAC(3-bromothiophen-2-yl)-(5-bromothiophen-2-yl)methanamine
SMILESNC(c1ccc(Br)s1)c1sccc1Br
InChIInChI=1S/C9H7Br2NS2/c10-5-3-4-13-9(5)8(12)6-1-2-7(11)14-6/h1-4,8H,12H2
InChIKeyFXZMWIUIHYQSAV-UHFFFAOYSA-N
MW353.10 g/mol
LogP4.38
Rot. Bonds2

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

(3-bromothiophen-2-yl)-(5-bromothiophen-2-yl)methanamine (PubChem CID 63798269) has the molecular formula C9H7Br2NS2 and a molecular weight of 353.10 g/mol. Its IUPAC name is (3-bromothiophen-2-yl)-(5-bromothiophen-2-yl)methanamine.

Molecular Properties

Compound Name(3-bromothiophen-2-yl)-(5-bromothiophen-2-yl)methanamine
PubChem CID63798269
Molecular FormulaC9H7Br2NS2
Molecular Weight353.10 g/mol
Exact Mass350.84
IUPAC Name(3-bromothiophen-2-yl)-(5-bromothiophen-2-yl)methanamine
SMILESNC(c1ccc(Br)s1)c1sccc1Br
InChIInChI=1S/C9H7Br2NS2/c10-5-3-4-13-9(5)8(12)6-1-2-7(11)14-6/h1-4,8H,12H2
InChIKeyFXZMWIUIHYQSAV-UHFFFAOYSA-N
XLogP4.38
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.10
LogP ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(5-bromo-4-chlorothiophen-2-yl)-(3-bromothiophen-2-yl)methanamine
CID 80530685
(R)-(3-bromothiophen-2-yl)-thiophen-2-ylmethanamine;hydrochloride
CID 171211028
(5-bromothiophen-2-yl)-(1,3-thiazol-2-yl)methanamine
CID 61347211
(3-bromothiophen-2-yl)-(4-bromothiophen-3-yl)methanamine
CID 105010950
(2-bromophenyl)-(5-bromothiophen-2-yl)methanamine
CID 61104167
(3-bromothiophen-2-yl)-(thiadiazol-4-yl)methanamine
CID 105172942
(5-bromothiophen-2-yl)-thiophen-3-ylmethanamine
CID 61102813
(3-bromothiophen-2-yl)-(4-propan-2-ylphenyl)methanamine
CID 63796873
(1S)-1-(3-bromothiophen-2-yl)-2-methylpropan-1-amine
CID 131098099
(3-bromothiophen-2-yl)-(2,6-dichlorophenyl)methanamine
CID 80534984
(5-bromothiophen-2-yl)-(5-methylthiophen-3-yl)methanamine
CID 65104934
(3-bromothiophen-2-yl)-(4-tert-butylphenyl)methanamine
CID 55240105

Frequently Asked Questions

What is the IUPAC name of (3-bromothiophen-2-yl)-(5-bromothiophen-2-yl)methanamine?
The IUPAC name of (3-bromothiophen-2-yl)-(5-bromothiophen-2-yl)methanamine (CID 63798269) is (3-bromothiophen-2-yl)-(5-bromothiophen-2-yl)methanamine.
What is the SMILES notation for (3-bromothiophen-2-yl)-(5-bromothiophen-2-yl)methanamine?
The canonical SMILES for (3-bromothiophen-2-yl)-(5-bromothiophen-2-yl)methanamine is NC(c1ccc(Br)s1)c1sccc1Br.
What is the InChIKey of (3-bromothiophen-2-yl)-(5-bromothiophen-2-yl)methanamine?
The InChIKey is FXZMWIUIHYQSAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7Br2NS2/c10-5-3-4-13-9(5)8(12)6-1-2-7(11)14-6/h1-4,8H,12H2.
What are the key properties of (3-bromothiophen-2-yl)-(5-bromothiophen-2-yl)methanamine?
(3-bromothiophen-2-yl)-(5-bromothiophen-2-yl)methanamine has a molecular weight of 353.10 g/mol, XLogP of 4.38, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-bromothiophen-2-yl)-(5-bromothiophen-2-yl)methanamine is sourced from PubChem (CID 63798269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).