5-bromo-2-methyl-N-(3-methylcyclopentyl)benzamide

C14H18BrNO — CID 114546768

IUPAC5-bromo-2-methyl-N-(3-methylcyclopentyl)benzamide
SMILESCc1ccc(Br)cc1C(=O)NC1CCC(C)C1
InChIInChI=1S/C14H18BrNO/c1-9-3-6-12(7-9)16-14(17)13-8-11(15)5-4-10(13)2/h4-5,8-9,12H,3,6-7H2,1-2H3,(H,16,17)
InChIKeyAZLHVVLXQCAXMA-UHFFFAOYSA-N
MW296.21 g/mol
LogP3.68
Rot. Bonds2

About 5-bromo-2-methyl-N-(3-methylcyclopentyl)benzamide

5-bromo-2-methyl-N-(3-methylcyclopentyl)benzamide (PubChem CID 114546768) has the molecular formula C14H18BrNO and a molecular weight of 296.21 g/mol. Its IUPAC name is 5-bromo-2-methyl-N-(3-methylcyclopentyl)benzamide.

Molecular Properties

Compound Name5-bromo-2-methyl-N-(3-methylcyclopentyl)benzamide
PubChem CID114546768
Molecular FormulaC14H18BrNO
Molecular Weight296.21 g/mol
Exact Mass295.06
IUPAC Name5-bromo-2-methyl-N-(3-methylcyclopentyl)benzamide
SMILESCc1ccc(Br)cc1C(=O)NC1CCC(C)C1
InChIInChI=1S/C14H18BrNO/c1-9-3-6-12(7-9)16-14(17)13-8-11(15)5-4-10(13)2/h4-5,8-9,12H,3,6-7H2,1-2H3,(H,16,17)
InChIKeyAZLHVVLXQCAXMA-UHFFFAOYSA-N
XLogP3.68
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.21
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 65309674
5-bromo-2-methyl-N-(1-methylpiperidin-4-yl)benzamide
CID 65306983
2-amino-5-bromo-N-(3-methylcyclopentyl)pyridine-3-carboxamide
CID 114540575
5-bromo-2-[(3-methylcyclopentyl)carbamoylamino]benzoic acid
CID 114548823
5-bromo-N-[(1S,2S)-2-hydroxycyclohexyl]-2-methylbenzamide
CID 104956752
N-(azepan-3-yl)-5-bromo-2-methylbenzamide
CID 65311485
5-bromo-N-(1,1-dioxothian-3-yl)-2-methylbenzamide
CID 65309683
N-(3-azabicyclo[3.1.0]hexan-6-yl)-5-bromo-2-methylbenzamide
CID 65312004
2,5-dihydroxy-N-(3-methylcyclopentyl)benzamide
CID 107723891
5-bromo-N-(2-bromocycloheptyl)-2-methylbenzamide
CID 113395138
4-bromo-N-(3,5-dimethylcyclohexyl)-2-fluorobenzamide
CID 64722332
2-hydrazinyl-4-methyl-N-(3-methylcyclopentyl)benzamide
CID 114541042

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-methyl-N-(3-methylcyclopentyl)benzamide?
The IUPAC name of 5-bromo-2-methyl-N-(3-methylcyclopentyl)benzamide (CID 114546768) is 5-bromo-2-methyl-N-(3-methylcyclopentyl)benzamide.
What is the SMILES notation for 5-bromo-2-methyl-N-(3-methylcyclopentyl)benzamide?
The canonical SMILES for 5-bromo-2-methyl-N-(3-methylcyclopentyl)benzamide is Cc1ccc(Br)cc1C(=O)NC1CCC(C)C1.
What is the InChIKey of 5-bromo-2-methyl-N-(3-methylcyclopentyl)benzamide?
The InChIKey is AZLHVVLXQCAXMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18BrNO/c1-9-3-6-12(7-9)16-14(17)13-8-11(15)5-4-10(13)2/h4-5,8-9,12H,3,6-7H2,1-2H3,(H,16,17).
What are the key properties of 5-bromo-2-methyl-N-(3-methylcyclopentyl)benzamide?
5-bromo-2-methyl-N-(3-methylcyclopentyl)benzamide has a molecular weight of 296.21 g/mol, XLogP of 3.68, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-methyl-N-(3-methylcyclopentyl)benzamide is sourced from PubChem (CID 114546768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).