(5-bromothiophen-2-yl)-(2,5-difluorophenyl)methanamine

C11H8BrF2NS — CID 43464242

IUPAC(5-bromothiophen-2-yl)-(2,5-difluorophenyl)methanamine
SMILESNC(c1ccc(Br)s1)c1cc(F)ccc1F
InChIInChI=1S/C11H8BrF2NS/c12-10-4-3-9(16-10)11(15)7-5-6(13)1-2-8(7)14/h1-5,11H,15H2
InChIKeyUYEGBYKCDRTAGS-UHFFFAOYSA-N
MW304.16 g/mol
LogP3.84
Rot. Bonds2

About (5-bromothiophen-2-yl)-(2,5-difluorophenyl)methanamine

(5-bromothiophen-2-yl)-(2,5-difluorophenyl)methanamine (PubChem CID 43464242) has the molecular formula C11H8BrF2NS and a molecular weight of 304.16 g/mol. Its IUPAC name is (5-bromothiophen-2-yl)-(2,5-difluorophenyl)methanamine.

Molecular Properties

Compound Name(5-bromothiophen-2-yl)-(2,5-difluorophenyl)methanamine
PubChem CID43464242
Molecular FormulaC11H8BrF2NS
Molecular Weight304.16 g/mol
Exact Mass302.95
IUPAC Name(5-bromothiophen-2-yl)-(2,5-difluorophenyl)methanamine
SMILESNC(c1ccc(Br)s1)c1cc(F)ccc1F
InChIInChI=1S/C11H8BrF2NS/c12-10-4-3-9(16-10)11(15)7-5-6(13)1-2-8(7)14/h1-5,11H,15H2
InChIKeyUYEGBYKCDRTAGS-UHFFFAOYSA-N
XLogP3.84
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.16
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(5-bromo-2-fluorophenyl)-(5-bromothiophen-2-yl)methanamine
CID 61104169
(4,5-dibromothiophen-2-yl)-(2,5-difluorophenyl)methanamine
CID 80536196
(2-bromo-4-chlorophenyl)-(5-bromothiophen-2-yl)methanamine
CID 107987471
2-bromo-5-[bromo-(2-bromo-5-fluorophenyl)methyl]thiophene
CID 63444372
(2,5-difluorophenyl)-thieno[3,2-b]thiophen-5-ylmethanamine
CID 80733937
(5-bromothiophen-2-yl)-(4-fluoro-2,6-dimethylphenyl)methanamine
CID 106877134
(2-bromo-5-fluorophenyl)-(5-bromothiophen-2-yl)methanol
CID 61081150
(2-bromophenyl)-(5-bromothiophen-2-yl)methanamine
CID 61104167
2-bromo-5-[chloro-(5-chloro-2-fluorophenyl)methyl]thiophene
CID 63435413
(2,5-difluorophenyl)-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)methanamine
CID 43384394
(5-bromothiophen-2-yl)-[2-(difluoromethoxy)phenyl]methanamine
CID 61102058
(5-bromothiophen-2-yl)-(2,4,5-trimethoxyphenyl)methanamine
CID 61104551

Frequently Asked Questions

What is the IUPAC name of (5-bromothiophen-2-yl)-(2,5-difluorophenyl)methanamine?
The IUPAC name of (5-bromothiophen-2-yl)-(2,5-difluorophenyl)methanamine (CID 43464242) is (5-bromothiophen-2-yl)-(2,5-difluorophenyl)methanamine.
What is the SMILES notation for (5-bromothiophen-2-yl)-(2,5-difluorophenyl)methanamine?
The canonical SMILES for (5-bromothiophen-2-yl)-(2,5-difluorophenyl)methanamine is NC(c1ccc(Br)s1)c1cc(F)ccc1F.
What is the InChIKey of (5-bromothiophen-2-yl)-(2,5-difluorophenyl)methanamine?
The InChIKey is UYEGBYKCDRTAGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8BrF2NS/c12-10-4-3-9(16-10)11(15)7-5-6(13)1-2-8(7)14/h1-5,11H,15H2.
What are the key properties of (5-bromothiophen-2-yl)-(2,5-difluorophenyl)methanamine?
(5-bromothiophen-2-yl)-(2,5-difluorophenyl)methanamine has a molecular weight of 304.16 g/mol, XLogP of 3.84, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-bromothiophen-2-yl)-(2,5-difluorophenyl)methanamine is sourced from PubChem (CID 43464242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).