(R)-(5-bromothiophen-3-yl)-cyclopropylmethanamine

C8H10BrNS — CID 130714035

IUPAC(R)-(5-bromothiophen-3-yl)-cyclopropylmethanamine
SMILESN[C@@H](c1csc(Br)c1)C1CC1
InChIInChI=1S/C8H10BrNS/c9-7-3-6(4-11-7)8(10)5-1-2-5/h3-5,8H,1-2,10H2/t8-/m1/s1
InChIKeyJQIJEUWGBWWPEE-MRVPVSSYSA-N
MW232.15 g/mol
LogP2.92
Rot. Bonds2

About (R)-(5-bromothiophen-3-yl)-cyclopropylmethanamine

(R)-(5-bromothiophen-3-yl)-cyclopropylmethanamine (PubChem CID 130714035) has the molecular formula C8H10BrNS and a molecular weight of 232.15 g/mol. Its IUPAC name is (R)-(5-bromothiophen-3-yl)-cyclopropylmethanamine.

Molecular Properties

Compound Name(R)-(5-bromothiophen-3-yl)-cyclopropylmethanamine
PubChem CID130714035
Molecular FormulaC8H10BrNS
Molecular Weight232.15 g/mol
Exact Mass230.97
IUPAC Name(R)-(5-bromothiophen-3-yl)-cyclopropylmethanamine
SMILESN[C@@H](c1csc(Br)c1)C1CC1
InChIInChI=1S/C8H10BrNS/c9-7-3-6(4-11-7)8(10)5-1-2-5/h3-5,8H,1-2,10H2/t8-/m1/s1
InChIKeyJQIJEUWGBWWPEE-MRVPVSSYSA-N
XLogP2.92
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.15
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (R)-(5-bromothiophen-3-yl)-cyclopropylmethanamine?
The IUPAC name of (R)-(5-bromothiophen-3-yl)-cyclopropylmethanamine (CID 130714035) is (R)-(5-bromothiophen-3-yl)-cyclopropylmethanamine.
What is the SMILES notation for (R)-(5-bromothiophen-3-yl)-cyclopropylmethanamine?
The canonical SMILES for (R)-(5-bromothiophen-3-yl)-cyclopropylmethanamine is N[C@@H](c1csc(Br)c1)C1CC1.
What is the InChIKey of (R)-(5-bromothiophen-3-yl)-cyclopropylmethanamine?
The InChIKey is JQIJEUWGBWWPEE-MRVPVSSYSA-N. The full InChI is InChI=1S/C8H10BrNS/c9-7-3-6(4-11-7)8(10)5-1-2-5/h3-5,8H,1-2,10H2/t8-/m1/s1.
What are the key properties of (R)-(5-bromothiophen-3-yl)-cyclopropylmethanamine?
(R)-(5-bromothiophen-3-yl)-cyclopropylmethanamine has a molecular weight of 232.15 g/mol, XLogP of 2.92, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-(5-bromothiophen-3-yl)-cyclopropylmethanamine is sourced from PubChem (CID 130714035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).