N-(2-amino-1-cyclopentylethyl)-4-fluoro-2-methylbenzamide

C15H21FN2O — CID 106737696

IUPACN-(2-amino-1-cyclopentylethyl)-4-fluoro-2-methylbenzamide
SMILESCc1cc(F)ccc1C(=O)NC(CN)C1CCCC1
InChIInChI=1S/C15H21FN2O/c1-10-8-12(16)6-7-13(10)15(19)18-14(9-17)11-4-2-3-5-11/h6-8,11,14H,2-5,9,17H2,1H3,(H,18,19)
InChIKeyHGFILBDYKVJRNU-UHFFFAOYSA-N
MW264.34 g/mol
LogP2.38
Rot. Bonds4

About N-(2-amino-1-cyclopentylethyl)-4-fluoro-2-methylbenzamide

N-(2-amino-1-cyclopentylethyl)-4-fluoro-2-methylbenzamide (PubChem CID 106737696) has the molecular formula C15H21FN2O and a molecular weight of 264.34 g/mol. Its IUPAC name is N-(2-amino-1-cyclopentylethyl)-4-fluoro-2-methylbenzamide.

Molecular Properties

Compound NameN-(2-amino-1-cyclopentylethyl)-4-fluoro-2-methylbenzamide
PubChem CID106737696
Molecular FormulaC15H21FN2O
Molecular Weight264.34 g/mol
Exact Mass264.16
IUPAC NameN-(2-amino-1-cyclopentylethyl)-4-fluoro-2-methylbenzamide
SMILESCc1cc(F)ccc1C(=O)NC(CN)C1CCCC1
InChIInChI=1S/C15H21FN2O/c1-10-8-12(16)6-7-13(10)15(19)18-14(9-17)11-4-2-3-5-11/h6-8,11,14H,2-5,9,17H2,1H3,(H,18,19)
InChIKeyHGFILBDYKVJRNU-UHFFFAOYSA-N
XLogP2.38
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.34
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-amino-1-cyclohexylethyl)-2-bromo-4-fluorobenzamide
CID 81486052
N-(2-amino-1-cyclohexylethyl)-2-methylbenzamide;hydrochloride
CID 119588952
N-(2-amino-1-cyclohexylethyl)-2-chloro-4-methylbenzamide
CID 106862320
N-(2-amino-1-cyclopropylethyl)-2,4-difluoro-5-methylbenzamide;hydrochloride
CID 119613251
N-(2-amino-1-cyclopropylethyl)-2-fluoro-5-methylbenzamide
CID 65188786
N-(2-amino-1-cyclopropylethyl)-3-fluoro-4-methylbenzamide;hydrochloride
CID 119614951
N-(2-amino-1-cyclopentylethyl)-2,5-dimethylfuran-3-carboxamide
CID 106737497
5-acetamido-N-(2-amino-1-cyclohexylethyl)-2-fluorobenzamide
CID 119589312
N-(2-amino-1-cyclohexylethyl)-2,4,6-trifluorobenzamide
CID 81487271
N-(2-amino-1-cyclopentylethyl)-4-bromo-2-hydroxybenzamide
CID 106737241
N-(2-amino-1-cyclopentylethyl)-4-methylsulfanylbenzamide
CID 106737308
N-(2-amino-1-cyclopropylethyl)-5-chloro-2-methylbenzamide
CID 82883177

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-cyclopentylethyl)-4-fluoro-2-methylbenzamide?
The IUPAC name of N-(2-amino-1-cyclopentylethyl)-4-fluoro-2-methylbenzamide (CID 106737696) is N-(2-amino-1-cyclopentylethyl)-4-fluoro-2-methylbenzamide.
What is the SMILES notation for N-(2-amino-1-cyclopentylethyl)-4-fluoro-2-methylbenzamide?
The canonical SMILES for N-(2-amino-1-cyclopentylethyl)-4-fluoro-2-methylbenzamide is Cc1cc(F)ccc1C(=O)NC(CN)C1CCCC1.
What is the InChIKey of N-(2-amino-1-cyclopentylethyl)-4-fluoro-2-methylbenzamide?
The InChIKey is HGFILBDYKVJRNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2O/c1-10-8-12(16)6-7-13(10)15(19)18-14(9-17)11-4-2-3-5-11/h6-8,11,14H,2-5,9,17H2,1H3,(H,18,19).
What are the key properties of N-(2-amino-1-cyclopentylethyl)-4-fluoro-2-methylbenzamide?
N-(2-amino-1-cyclopentylethyl)-4-fluoro-2-methylbenzamide has a molecular weight of 264.34 g/mol, XLogP of 2.38, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1-cyclopentylethyl)-4-fluoro-2-methylbenzamide is sourced from PubChem (CID 106737696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).