5-bromo-N-cyclopentyl-N-ethyl-2-methylbenzamide

C15H20BrNO — CID 65306938

IUPAC5-bromo-N-cyclopentyl-N-ethyl-2-methylbenzamide
SMILESCCN(C(=O)c1cc(Br)ccc1C)C1CCCC1
InChIInChI=1S/C15H20BrNO/c1-3-17(13-6-4-5-7-13)15(18)14-10-12(16)9-8-11(14)2/h8-10,13H,3-7H2,1-2H3
InChIKeyJLYIOEZCLZFIJA-UHFFFAOYSA-N
MW310.23 g/mol
LogP4.16
Rot. Bonds3

About 5-bromo-N-cyclopentyl-N-ethyl-2-methylbenzamide

5-bromo-N-cyclopentyl-N-ethyl-2-methylbenzamide (PubChem CID 65306938) has the molecular formula C15H20BrNO and a molecular weight of 310.23 g/mol. Its IUPAC name is 5-bromo-N-cyclopentyl-N-ethyl-2-methylbenzamide.

Molecular Properties

Compound Name5-bromo-N-cyclopentyl-N-ethyl-2-methylbenzamide
PubChem CID65306938
Molecular FormulaC15H20BrNO
Molecular Weight310.23 g/mol
Exact Mass309.07
IUPAC Name5-bromo-N-cyclopentyl-N-ethyl-2-methylbenzamide
SMILESCCN(C(=O)c1cc(Br)ccc1C)C1CCCC1
InChIInChI=1S/C15H20BrNO/c1-3-17(13-6-4-5-7-13)15(18)14-10-12(16)9-8-11(14)2/h8-10,13H,3-7H2,1-2H3
InChIKeyJLYIOEZCLZFIJA-UHFFFAOYSA-N
XLogP4.16
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.23
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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N-cyclopentyl-N-ethyl-4-hydroxy-2-methylbenzamide
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CID 65309509
2-amino-5-bromo-N-cyclopentyl-N-ethylpyridine-3-carboxamide
CID 62153959
5-bromo-N,2-dimethyl-N-(3-methylcyclohexyl)benzamide
CID 65309384
2,4-dibromo-N-ethyl-N-piperidin-3-ylbenzamide
CID 107939910
2-bromo-N-cyclohexyl-N-ethyl-5-sulfanylbenzamide
CID 107020962
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Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-cyclopentyl-N-ethyl-2-methylbenzamide?
The IUPAC name of 5-bromo-N-cyclopentyl-N-ethyl-2-methylbenzamide (CID 65306938) is 5-bromo-N-cyclopentyl-N-ethyl-2-methylbenzamide.
What is the SMILES notation for 5-bromo-N-cyclopentyl-N-ethyl-2-methylbenzamide?
The canonical SMILES for 5-bromo-N-cyclopentyl-N-ethyl-2-methylbenzamide is CCN(C(=O)c1cc(Br)ccc1C)C1CCCC1.
What is the InChIKey of 5-bromo-N-cyclopentyl-N-ethyl-2-methylbenzamide?
The InChIKey is JLYIOEZCLZFIJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20BrNO/c1-3-17(13-6-4-5-7-13)15(18)14-10-12(16)9-8-11(14)2/h8-10,13H,3-7H2,1-2H3.
What are the key properties of 5-bromo-N-cyclopentyl-N-ethyl-2-methylbenzamide?
5-bromo-N-cyclopentyl-N-ethyl-2-methylbenzamide has a molecular weight of 310.23 g/mol, XLogP of 4.16, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-cyclopentyl-N-ethyl-2-methylbenzamide is sourced from PubChem (CID 65306938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).