5-bromo-N-(2-hydroxycyclohexyl)thiophene-2-carboxamide

C11H14BrNO2S — CID 62360157

IUPAC5-bromo-N-(2-hydroxycyclohexyl)thiophene-2-carboxamide
SMILESO=C(NC1CCCCC1O)c1ccc(Br)s1
InChIInChI=1S/C11H14BrNO2S/c12-10-6-5-9(16-10)11(15)13-7-3-1-2-4-8(7)14/h5-8,14H,1-4H2,(H,13,15)
InChIKeyMZIUMEXMIRJVMQ-UHFFFAOYSA-N
MW304.21 g/mol
LogP2.54
Rot. Bonds2

About 5-bromo-N-(2-hydroxycyclohexyl)thiophene-2-carboxamide

5-bromo-N-(2-hydroxycyclohexyl)thiophene-2-carboxamide (PubChem CID 62360157) has the molecular formula C11H14BrNO2S and a molecular weight of 304.21 g/mol. Its IUPAC name is 5-bromo-N-(2-hydroxycyclohexyl)thiophene-2-carboxamide.

Molecular Properties

Compound Name5-bromo-N-(2-hydroxycyclohexyl)thiophene-2-carboxamide
PubChem CID62360157
Molecular FormulaC11H14BrNO2S
Molecular Weight304.21 g/mol
Exact Mass302.99
IUPAC Name5-bromo-N-(2-hydroxycyclohexyl)thiophene-2-carboxamide
SMILESO=C(NC1CCCCC1O)c1ccc(Br)s1
InChIInChI=1S/C11H14BrNO2S/c12-10-6-5-9(16-10)11(15)13-7-3-1-2-4-8(7)14/h5-8,14H,1-4H2,(H,13,15)
InChIKeyMZIUMEXMIRJVMQ-UHFFFAOYSA-N
XLogP2.54
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.21
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(5-bromothiophene-2-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 64814788
N-[(1S,2S)-2-hydroxycyclohexyl]-5-methylthiophene-2-carboxamide
CID 104957425
4-[(5-bromothiophene-2-carbonyl)amino]oxolane-3-carboxylic acid
CID 66222915
5-bromo-N-(cyclobutylmethyl)thiophene-2-carboxamide
CID 33372780
4-bromo-N-[(1R,2R)-2-hydroxycyclohexyl]benzamide
CID 27109566
4-bromo-N-(2-hydroxycyclohexyl)benzamide
CID 3294155
5-bromo-N-cyclopentyloxythiophene-2-carboxamide
CID 83202790
3-bromo-N-[(1R,2R)-2-hydroxycyclohexyl]thiophene-2-carboxamide
CID 104927269
1-[2-(5-bromothiophen-2-yl)ethyl]-3-(2-hydroxycyclohexyl)urea
CID 110933217
5-bromo-N-[2-(cycloheptylamino)ethyl]thiophene-2-carboxamide
CID 81483299
5-bromo-N-(2-oxopiperidin-3-yl)thiophene-2-carboxamide
CID 49149527
N-(2-hydroxycyclohexyl)thiadiazole-5-carboxamide
CID 62358685

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(2-hydroxycyclohexyl)thiophene-2-carboxamide?
The IUPAC name of 5-bromo-N-(2-hydroxycyclohexyl)thiophene-2-carboxamide (CID 62360157) is 5-bromo-N-(2-hydroxycyclohexyl)thiophene-2-carboxamide.
What is the SMILES notation for 5-bromo-N-(2-hydroxycyclohexyl)thiophene-2-carboxamide?
The canonical SMILES for 5-bromo-N-(2-hydroxycyclohexyl)thiophene-2-carboxamide is O=C(NC1CCCCC1O)c1ccc(Br)s1.
What is the InChIKey of 5-bromo-N-(2-hydroxycyclohexyl)thiophene-2-carboxamide?
The InChIKey is MZIUMEXMIRJVMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14BrNO2S/c12-10-6-5-9(16-10)11(15)13-7-3-1-2-4-8(7)14/h5-8,14H,1-4H2,(H,13,15).
What are the key properties of 5-bromo-N-(2-hydroxycyclohexyl)thiophene-2-carboxamide?
5-bromo-N-(2-hydroxycyclohexyl)thiophene-2-carboxamide has a molecular weight of 304.21 g/mol, XLogP of 2.54, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(2-hydroxycyclohexyl)thiophene-2-carboxamide is sourced from PubChem (CID 62360157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).