1-(5-bromothiophen-2-yl)sulfonylcyclopropan-1-amine

C7H8BrNO2S2 — CID 117037932

IUPAC1-(5-bromothiophen-2-yl)sulfonylcyclopropan-1-amine
SMILESNC1(S(=O)(=O)c2ccc(Br)s2)CC1
InChIInChI=1S/C7H8BrNO2S2/c8-5-1-2-6(12-5)13(10,11)7(9)3-4-7/h1-2H,3-4,9H2
InChIKeyIBMNUXKROGMPQS-UHFFFAOYSA-N
MW282.18 g/mol
LogP1.73
Rot. Bonds2

About 1-(5-bromothiophen-2-yl)sulfonylcyclopropan-1-amine

1-(5-bromothiophen-2-yl)sulfonylcyclopropan-1-amine (PubChem CID 117037932) has the molecular formula C7H8BrNO2S2 and a molecular weight of 282.18 g/mol. Its IUPAC name is 1-(5-bromothiophen-2-yl)sulfonylcyclopropan-1-amine.

Molecular Properties

Compound Name1-(5-bromothiophen-2-yl)sulfonylcyclopropan-1-amine
PubChem CID117037932
Molecular FormulaC7H8BrNO2S2
Molecular Weight282.18 g/mol
Exact Mass280.92
IUPAC Name1-(5-bromothiophen-2-yl)sulfonylcyclopropan-1-amine
SMILESNC1(S(=O)(=O)c2ccc(Br)s2)CC1
InChIInChI=1S/C7H8BrNO2S2/c8-5-1-2-6(12-5)13(10,11)7(9)3-4-7/h1-2H,3-4,9H2
InChIKeyIBMNUXKROGMPQS-UHFFFAOYSA-N
XLogP1.73
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.18
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(5-bromothiophen-2-yl)sulfonylcyclopropane-1-carboxylic acid
CID 117032269
5-bromothiophene-2-sulfonohydrazide
CID 23464136
5-bromo-N-[1-(bromomethyl)cyclopentyl]thiophene-2-sulfonamide
CID 114297084
5-bromo-N-[1-(bromomethyl)cyclohexyl]thiophene-2-sulfonamide
CID 114293728
[(5-bromothiophen-2-yl)sulfonylamino]thiourea
CID 65214417
1-(5-bromothiophen-2-yl)sulfonylpyrazol-3-amine
CID 110868060
1-(5-bromothiophen-2-yl)sulfonylazepane
CID 893724
1-(5-bromothiophen-2-yl)sulfanylcyclopropan-1-amine
CID 117035870
(5-bromothiophen-2-yl)sulfonyl-methylcarbamic acid
CID 67189352
8-(5-bromothiophen-2-yl)sulfonyl-8-azabicyclo[3.2.1]octan-3-amine
CID 61234061
4-(5-bromothiophen-2-yl)sulfonylcyclohexan-1-one
CID 117037255
1-(5-bromothiophen-2-yl)sulfonylpyrazole
CID 3237735

Frequently Asked Questions

What is the IUPAC name of 1-(5-bromothiophen-2-yl)sulfonylcyclopropan-1-amine?
The IUPAC name of 1-(5-bromothiophen-2-yl)sulfonylcyclopropan-1-amine (CID 117037932) is 1-(5-bromothiophen-2-yl)sulfonylcyclopropan-1-amine.
What is the SMILES notation for 1-(5-bromothiophen-2-yl)sulfonylcyclopropan-1-amine?
The canonical SMILES for 1-(5-bromothiophen-2-yl)sulfonylcyclopropan-1-amine is NC1(S(=O)(=O)c2ccc(Br)s2)CC1.
What is the InChIKey of 1-(5-bromothiophen-2-yl)sulfonylcyclopropan-1-amine?
The InChIKey is IBMNUXKROGMPQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8BrNO2S2/c8-5-1-2-6(12-5)13(10,11)7(9)3-4-7/h1-2H,3-4,9H2.
What are the key properties of 1-(5-bromothiophen-2-yl)sulfonylcyclopropan-1-amine?
1-(5-bromothiophen-2-yl)sulfonylcyclopropan-1-amine has a molecular weight of 282.18 g/mol, XLogP of 1.73, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-bromothiophen-2-yl)sulfonylcyclopropan-1-amine is sourced from PubChem (CID 117037932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).