5-bromo-N-cyclopentyl-N-(2-methylpropyl)thiophene-2-carboxamide

C14H20BrNOS — CID 113221746

IUPAC5-bromo-N-cyclopentyl-N-(2-methylpropyl)thiophene-2-carboxamide
SMILESCC(C)CN(C(=O)c1ccc(Br)s1)C1CCCC1
InChIInChI=1S/C14H20BrNOS/c1-10(2)9-16(11-5-3-4-6-11)14(17)12-7-8-13(15)18-12/h7-8,10-11H,3-6,9H2,1-2H3
InChIKeyCOYDNOBILOLBMT-UHFFFAOYSA-N
MW330.29 g/mol
LogP4.55
Rot. Bonds4

About 5-bromo-N-cyclopentyl-N-(2-methylpropyl)thiophene-2-carboxamide

5-bromo-N-cyclopentyl-N-(2-methylpropyl)thiophene-2-carboxamide (PubChem CID 113221746) has the molecular formula C14H20BrNOS and a molecular weight of 330.29 g/mol. Its IUPAC name is 5-bromo-N-cyclopentyl-N-(2-methylpropyl)thiophene-2-carboxamide.

Molecular Properties

Compound Name5-bromo-N-cyclopentyl-N-(2-methylpropyl)thiophene-2-carboxamide
PubChem CID113221746
Molecular FormulaC14H20BrNOS
Molecular Weight330.29 g/mol
Exact Mass329.04
IUPAC Name5-bromo-N-cyclopentyl-N-(2-methylpropyl)thiophene-2-carboxamide
SMILESCC(C)CN(C(=O)c1ccc(Br)s1)C1CCCC1
InChIInChI=1S/C14H20BrNOS/c1-10(2)9-16(11-5-3-4-6-11)14(17)12-7-8-13(15)18-12/h7-8,10-11H,3-6,9H2,1-2H3
InChIKeyCOYDNOBILOLBMT-UHFFFAOYSA-N
XLogP4.55
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.29
LogP ≤ 54.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-bromo-N-(2-bromoethyl)-N-cyclopentylthiophene-2-carboxamide
CID 80659510
3-bromo-N-cyclopentyl-N-(2-methylpropyl)thiophene-2-carboxamide
CID 113223704
N-(2-amino-2-hydroxyiminoethyl)-5-bromo-N-cyclopentylthiophene-2-carboxamide
CID 77038217
5-bromo-N-cyclopentyl-N-(2-methylpropyl)furan-2-carboxamide
CID 112725800
5-bromo-N-cyclopropyl-N-(piperidin-2-ylmethyl)thiophene-2-carboxamide
CID 106626893
N-(4-aminocyclohexyl)-5-bromo-N-propylthiophene-2-carboxamide
CID 79111791
N-(azetidin-3-yl)-5-bromo-N-propylthiophene-2-carboxamide
CID 66182885
5-bromo-N-methyl-N-(1-propan-2-ylpiperidin-4-yl)thiophene-2-carboxamide
CID 60725126
5-chloro-N-cyclopentyl-N-(2-methylpropyl)-1,3,4-thiadiazole-2-carboxamide
CID 80619458
4-bromo-N-cyclopentyl-2-fluoro-N-(2-methylpropyl)benzamide
CID 112725824
2-bromo-N-cyclopentyl-N-(2-methylpropyl)-5-sulfanylbenzamide
CID 107032458
2-bromo-N-cyclopentyl-6-fluoro-N-(2-methylpropyl)benzamide
CID 114559684

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-cyclopentyl-N-(2-methylpropyl)thiophene-2-carboxamide?
The IUPAC name of 5-bromo-N-cyclopentyl-N-(2-methylpropyl)thiophene-2-carboxamide (CID 113221746) is 5-bromo-N-cyclopentyl-N-(2-methylpropyl)thiophene-2-carboxamide.
What is the SMILES notation for 5-bromo-N-cyclopentyl-N-(2-methylpropyl)thiophene-2-carboxamide?
The canonical SMILES for 5-bromo-N-cyclopentyl-N-(2-methylpropyl)thiophene-2-carboxamide is CC(C)CN(C(=O)c1ccc(Br)s1)C1CCCC1.
What is the InChIKey of 5-bromo-N-cyclopentyl-N-(2-methylpropyl)thiophene-2-carboxamide?
The InChIKey is COYDNOBILOLBMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20BrNOS/c1-10(2)9-16(11-5-3-4-6-11)14(17)12-7-8-13(15)18-12/h7-8,10-11H,3-6,9H2,1-2H3.
What are the key properties of 5-bromo-N-cyclopentyl-N-(2-methylpropyl)thiophene-2-carboxamide?
5-bromo-N-cyclopentyl-N-(2-methylpropyl)thiophene-2-carboxamide has a molecular weight of 330.29 g/mol, XLogP of 4.55, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-cyclopentyl-N-(2-methylpropyl)thiophene-2-carboxamide is sourced from PubChem (CID 113221746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).