N-[2-(aminomethyl)cyclopentyl]-2-fluoro-4-hydroxy-N-methylbenzamide

C14H19FN2O2 — CID 107677154

IUPACN-[2-(aminomethyl)cyclopentyl]-2-fluoro-4-hydroxy-N-methylbenzamide
SMILESCN(C(=O)c1ccc(O)cc1F)C1CCCC1CN
InChIInChI=1S/C14H19FN2O2/c1-17(13-4-2-3-9(13)8-16)14(19)11-6-5-10(18)7-12(11)15/h5-7,9,13,18H,2-4,8,16H2,1H3
InChIKeyVMNFDXCQAIUGTR-UHFFFAOYSA-N
MW266.32 g/mol
LogP1.73
Rot. Bonds3

About N-[2-(aminomethyl)cyclopentyl]-2-fluoro-4-hydroxy-N-methylbenzamide

N-[2-(aminomethyl)cyclopentyl]-2-fluoro-4-hydroxy-N-methylbenzamide (PubChem CID 107677154) has the molecular formula C14H19FN2O2 and a molecular weight of 266.32 g/mol. Its IUPAC name is N-[2-(aminomethyl)cyclopentyl]-2-fluoro-4-hydroxy-N-methylbenzamide.

Molecular Properties

Compound NameN-[2-(aminomethyl)cyclopentyl]-2-fluoro-4-hydroxy-N-methylbenzamide
PubChem CID107677154
Molecular FormulaC14H19FN2O2
Molecular Weight266.32 g/mol
Exact Mass266.14
IUPAC NameN-[2-(aminomethyl)cyclopentyl]-2-fluoro-4-hydroxy-N-methylbenzamide
SMILESCN(C(=O)c1ccc(O)cc1F)C1CCCC1CN
InChIInChI=1S/C14H19FN2O2/c1-17(13-4-2-3-9(13)8-16)14(19)11-6-5-10(18)7-12(11)15/h5-7,9,13,18H,2-4,8,16H2,1H3
InChIKeyVMNFDXCQAIUGTR-UHFFFAOYSA-N
XLogP1.73
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.32
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclobutyl-2-fluoro-4-hydroxy-N-methylbenzamide
CID 103940219
N-cyclopropyl-2-fluoro-4-hydroxy-N-methylbenzamide
CID 103940160
N-[2-(aminomethyl)cyclohexyl]-2-fluoro-6-hydroxy-N-methylbenzamide
CID 107015942
N-[2-(aminomethyl)cyclopentyl]-2-bromo-N,5-dimethylbenzamide
CID 81112557
N-[2-(aminomethyl)cyclohexyl]-3-chloro-4-fluoro-N-methylbenzamide
CID 82880142
N-[2-(aminomethyl)cyclohexyl]-3-hydroxy-N-methylpyridine-4-carboxamide
CID 81442866
N-[2-(aminomethyl)cyclohexyl]-4-hydroxy-N,3-dimethylbenzamide
CID 107672133
N-[2-(aminomethyl)cyclohexyl]-2,5-dibromo-N-methylthiophene-3-carboxamide
CID 107963621
2-fluoro-4-hydroxy-N-methyl-N-(oxolan-3-yl)benzamide
CID 104929947
N-[2-(aminomethyl)cyclohexyl]-5-fluoro-N-methylpyridine-2-carboxamide
CID 104639305
N-(2-aminocyclohexyl)-2-fluoro-4-methoxy-N-methylbenzamide
CID 102885408
2-fluoro-N-[2-[(2-fluoro-4-methoxybenzoyl)-methylamino]cyclohexyl]-4-methoxy-N-methylbenzamide
CID 166182143

Frequently Asked Questions

What is the IUPAC name of N-[2-(aminomethyl)cyclopentyl]-2-fluoro-4-hydroxy-N-methylbenzamide?
The IUPAC name of N-[2-(aminomethyl)cyclopentyl]-2-fluoro-4-hydroxy-N-methylbenzamide (CID 107677154) is N-[2-(aminomethyl)cyclopentyl]-2-fluoro-4-hydroxy-N-methylbenzamide.
What is the SMILES notation for N-[2-(aminomethyl)cyclopentyl]-2-fluoro-4-hydroxy-N-methylbenzamide?
The canonical SMILES for N-[2-(aminomethyl)cyclopentyl]-2-fluoro-4-hydroxy-N-methylbenzamide is CN(C(=O)c1ccc(O)cc1F)C1CCCC1CN.
What is the InChIKey of N-[2-(aminomethyl)cyclopentyl]-2-fluoro-4-hydroxy-N-methylbenzamide?
The InChIKey is VMNFDXCQAIUGTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN2O2/c1-17(13-4-2-3-9(13)8-16)14(19)11-6-5-10(18)7-12(11)15/h5-7,9,13,18H,2-4,8,16H2,1H3.
What are the key properties of N-[2-(aminomethyl)cyclopentyl]-2-fluoro-4-hydroxy-N-methylbenzamide?
N-[2-(aminomethyl)cyclopentyl]-2-fluoro-4-hydroxy-N-methylbenzamide has a molecular weight of 266.32 g/mol, XLogP of 1.73, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(aminomethyl)cyclopentyl]-2-fluoro-4-hydroxy-N-methylbenzamide is sourced from PubChem (CID 107677154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).