5-bromo-N-(cyclobutylmethyl)thiophene-3-carboxamide

C10H12BrNOS — CID 33383602

IUPAC5-bromo-N-(cyclobutylmethyl)thiophene-3-carboxamide
SMILESO=C(NCC1CCC1)c1csc(Br)c1
InChIInChI=1S/C10H12BrNOS/c11-9-4-8(6-14-9)10(13)12-5-7-2-1-3-7/h4,6-7H,1-3,5H2,(H,12,13)
InChIKeySKKUQBVKXSSFBO-UHFFFAOYSA-N
MW274.18 g/mol
LogP3.04
Rot. Bonds3

About 5-bromo-N-(cyclobutylmethyl)thiophene-3-carboxamide

5-bromo-N-(cyclobutylmethyl)thiophene-3-carboxamide (PubChem CID 33383602) has the molecular formula C10H12BrNOS and a molecular weight of 274.18 g/mol. Its IUPAC name is 5-bromo-N-(cyclobutylmethyl)thiophene-3-carboxamide.

Molecular Properties

Compound Name5-bromo-N-(cyclobutylmethyl)thiophene-3-carboxamide
PubChem CID33383602
Molecular FormulaC10H12BrNOS
Molecular Weight274.18 g/mol
Exact Mass272.98
IUPAC Name5-bromo-N-(cyclobutylmethyl)thiophene-3-carboxamide
SMILESO=C(NCC1CCC1)c1csc(Br)c1
InChIInChI=1S/C10H12BrNOS/c11-9-4-8(6-14-9)10(13)12-5-7-2-1-3-7/h4,6-7H,1-3,5H2,(H,12,13)
InChIKeySKKUQBVKXSSFBO-UHFFFAOYSA-N
XLogP3.04
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.18
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-bromo-N-[(4-ethylcyclohexyl)methyl]thiophene-3-carboxamide
CID 63525997
5-bromo-N-[(4-methylcyclohexyl)methyl]thiophene-3-carboxamide
CID 61380978
5-bromo-N-(oxan-3-ylmethyl)thiophene-3-carboxamide
CID 61019351
5-bromo-N-[(2-bromocyclopentyl)methyl]thiophene-3-carboxamide
CID 107966151
N-(cyclopentylmethyl)-5-iodothiophene-3-carboxamide
CID 78948345
5-bromo-N-[2-(cyclopropylamino)ethyl]thiophene-3-carboxamide
CID 103806386
4-(cyclopentylmethylcarbamoyl)thiophene-2-sulfonyl chloride
CID 65371125
5-bromo-N-(cyclobutylmethyl)-N-methylthiophene-3-carboxamide
CID 62861189
5-bromo-N-[2-(cyclopropylamino)-2-oxoethyl]thiophene-3-carboxamide
CID 43424485
5-bromo-N-(2-chloro-2-cyclopropylethyl)thiophene-3-carboxamide
CID 107966074
N-[(3-chlorocyclohexyl)methyl]-5-iodothiophene-3-carboxamide
CID 106132272
5-bromo-N-(cyclobutylmethyl)thiophene-2-carboxamide
CID 33372780

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(cyclobutylmethyl)thiophene-3-carboxamide?
The IUPAC name of 5-bromo-N-(cyclobutylmethyl)thiophene-3-carboxamide (CID 33383602) is 5-bromo-N-(cyclobutylmethyl)thiophene-3-carboxamide.
What is the SMILES notation for 5-bromo-N-(cyclobutylmethyl)thiophene-3-carboxamide?
The canonical SMILES for 5-bromo-N-(cyclobutylmethyl)thiophene-3-carboxamide is O=C(NCC1CCC1)c1csc(Br)c1.
What is the InChIKey of 5-bromo-N-(cyclobutylmethyl)thiophene-3-carboxamide?
The InChIKey is SKKUQBVKXSSFBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12BrNOS/c11-9-4-8(6-14-9)10(13)12-5-7-2-1-3-7/h4,6-7H,1-3,5H2,(H,12,13).
What are the key properties of 5-bromo-N-(cyclobutylmethyl)thiophene-3-carboxamide?
5-bromo-N-(cyclobutylmethyl)thiophene-3-carboxamide has a molecular weight of 274.18 g/mol, XLogP of 3.04, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(cyclobutylmethyl)thiophene-3-carboxamide is sourced from PubChem (CID 33383602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).