N-(2,3-dimethylcyclopentyl)-2-fluorobenzamide

C14H18FNO — CID 64907181

IUPACN-(2,3-dimethylcyclopentyl)-2-fluorobenzamide
SMILESCC1CCC(NC(=O)c2ccccc2F)C1C
InChIInChI=1S/C14H18FNO/c1-9-7-8-13(10(9)2)16-14(17)11-5-3-4-6-12(11)15/h3-6,9-10,13H,7-8H2,1-2H3,(H,16,17)
InChIKeyPAANZHCKLYIJMZ-UHFFFAOYSA-N
MW235.30 g/mol
LogP2.99
Rot. Bonds2

About N-(2,3-dimethylcyclopentyl)-2-fluorobenzamide

N-(2,3-dimethylcyclopentyl)-2-fluorobenzamide (PubChem CID 64907181) has the molecular formula C14H18FNO and a molecular weight of 235.30 g/mol. Its IUPAC name is N-(2,3-dimethylcyclopentyl)-2-fluorobenzamide.

Molecular Properties

Compound NameN-(2,3-dimethylcyclopentyl)-2-fluorobenzamide
PubChem CID64907181
Molecular FormulaC14H18FNO
Molecular Weight235.30 g/mol
Exact Mass235.14
IUPAC NameN-(2,3-dimethylcyclopentyl)-2-fluorobenzamide
SMILESCC1CCC(NC(=O)c2ccccc2F)C1C
InChIInChI=1S/C14H18FNO/c1-9-7-8-13(10(9)2)16-14(17)11-5-3-4-6-12(11)15/h3-6,9-10,13H,7-8H2,1-2H3,(H,16,17)
InChIKeyPAANZHCKLYIJMZ-UHFFFAOYSA-N
XLogP2.99
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.30
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-fluoro-N-(2-methylcyclohexyl)benzamide
CID 51166100
N-(2,3-dimethylcyclopentyl)-2-(ethylamino)benzamide
CID 64923029
N-[(1R,2S,3R)-2,3-dimethylcyclohexyl]-2,6-difluorobenzamide
CID 124811505
N-(2,3-dimethylcyclohexyl)-2-fluoro-3-methylbenzamide
CID 80718134
2,3-difluoro-N-(2-methylcyclopropyl)benzamide
CID 62661294
2-amino-N-(2,3-dimethylcyclohexyl)benzamide;hydrochloride
CID 119943682
2-[(2,3-dimethylcyclopentyl)amino]-3-fluorobenzoic acid
CID 64920642
N-(2,3-dimethylcyclopentyl)-2-(4-hydroxybut-1-ynyl)benzamide
CID 64920882
N-(3,5-dimethylcyclohexyl)-2-fluorobenzamide
CID 64724976
4-bromo-N-(2,3-dimethylcyclopentyl)-3-fluorobenzamide
CID 64920634
1-amino-N-(2,3-dimethylcyclopentyl)isoquinoline-4-carboxamide
CID 106772163
2-fluoro-N-[(1R,3S)-3-methylcyclohexyl]benzamide
CID 41097249

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylcyclopentyl)-2-fluorobenzamide?
The IUPAC name of N-(2,3-dimethylcyclopentyl)-2-fluorobenzamide (CID 64907181) is N-(2,3-dimethylcyclopentyl)-2-fluorobenzamide.
What is the SMILES notation for N-(2,3-dimethylcyclopentyl)-2-fluorobenzamide?
The canonical SMILES for N-(2,3-dimethylcyclopentyl)-2-fluorobenzamide is CC1CCC(NC(=O)c2ccccc2F)C1C.
What is the InChIKey of N-(2,3-dimethylcyclopentyl)-2-fluorobenzamide?
The InChIKey is PAANZHCKLYIJMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18FNO/c1-9-7-8-13(10(9)2)16-14(17)11-5-3-4-6-12(11)15/h3-6,9-10,13H,7-8H2,1-2H3,(H,16,17).
What are the key properties of N-(2,3-dimethylcyclopentyl)-2-fluorobenzamide?
N-(2,3-dimethylcyclopentyl)-2-fluorobenzamide has a molecular weight of 235.30 g/mol, XLogP of 2.99, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylcyclopentyl)-2-fluorobenzamide is sourced from PubChem (CID 64907181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).