N-(2-aminocyclopropyl)-2-fluoro-4-methoxybenzamide

C11H13FN2O2 — CID 103804989

IUPACN-(2-aminocyclopropyl)-2-fluoro-4-methoxybenzamide
SMILESCOc1ccc(C(=O)NC2CC2N)c(F)c1
InChIInChI=1S/C11H13FN2O2/c1-16-6-2-3-7(8(12)4-6)11(15)14-10-5-9(10)13/h2-4,9-10H,5,13H2,1H3,(H,14,15)
InChIKeyAPZOBFSCRNCQHF-UHFFFAOYSA-N
MW224.23 g/mol
LogP0.66
Rot. Bonds3

About N-(2-aminocyclopropyl)-2-fluoro-4-methoxybenzamide

N-(2-aminocyclopropyl)-2-fluoro-4-methoxybenzamide (PubChem CID 103804989) has the molecular formula C11H13FN2O2 and a molecular weight of 224.23 g/mol. Its IUPAC name is N-(2-aminocyclopropyl)-2-fluoro-4-methoxybenzamide.

Molecular Properties

Compound NameN-(2-aminocyclopropyl)-2-fluoro-4-methoxybenzamide
PubChem CID103804989
Molecular FormulaC11H13FN2O2
Molecular Weight224.23 g/mol
Exact Mass224.10
IUPAC NameN-(2-aminocyclopropyl)-2-fluoro-4-methoxybenzamide
SMILESCOc1ccc(C(=O)NC2CC2N)c(F)c1
InChIInChI=1S/C11H13FN2O2/c1-16-6-2-3-7(8(12)4-6)11(15)14-10-5-9(10)13/h2-4,9-10H,5,13H2,1H3,(H,14,15)
InChIKeyAPZOBFSCRNCQHF-UHFFFAOYSA-N
XLogP0.66
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.23
LogP ≤ 50.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-aminocycloheptyl)-2-fluoro-4-methoxybenzamide
CID 102883992
N-(2-aminocyclopropyl)-2-hydroxy-4-methoxybenzamide
CID 43593875
2-fluoro-4-methoxy-N-(2-propylcyclopropyl)benzamide
CID 103713574
2-fluoro-N-(2-hydroxycyclohexyl)-4-methoxybenzamide
CID 103816699
N-(2-amino-4-ethoxycyclobutyl)-2-fluoro-4-methoxybenzamide
CID 102884059
N-(2-bromocyclopentyl)-2-fluoro-4-methoxybenzamide
CID 102883574
2-[(2-fluoro-4-methoxybenzoyl)amino]cyclohexane-1-carboxylic acid
CID 103790786
cis-(1R,2S)-2-[(2-fluoro-4-methoxybenzoyl)amino]cycloheptane-1-carboxamide
CID 97063399
2-fluoro-4-methoxy-N-(3-tricyclo[3.2.1.02,4]octanyl)benzamide
CID 103767118
2-fluoro-N,4-dimethoxybenzamide
CID 103606176
N-(4-bromocyclohexyl)-2-fluoro-4-methoxybenzamide
CID 102885227
N-(2-aminocyclopropyl)-5-chloro-2-methoxybenzamide
CID 43593837

Frequently Asked Questions

What is the IUPAC name of N-(2-aminocyclopropyl)-2-fluoro-4-methoxybenzamide?
The IUPAC name of N-(2-aminocyclopropyl)-2-fluoro-4-methoxybenzamide (CID 103804989) is N-(2-aminocyclopropyl)-2-fluoro-4-methoxybenzamide.
What is the SMILES notation for N-(2-aminocyclopropyl)-2-fluoro-4-methoxybenzamide?
The canonical SMILES for N-(2-aminocyclopropyl)-2-fluoro-4-methoxybenzamide is COc1ccc(C(=O)NC2CC2N)c(F)c1.
What is the InChIKey of N-(2-aminocyclopropyl)-2-fluoro-4-methoxybenzamide?
The InChIKey is APZOBFSCRNCQHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FN2O2/c1-16-6-2-3-7(8(12)4-6)11(15)14-10-5-9(10)13/h2-4,9-10H,5,13H2,1H3,(H,14,15).
What are the key properties of N-(2-aminocyclopropyl)-2-fluoro-4-methoxybenzamide?
N-(2-aminocyclopropyl)-2-fluoro-4-methoxybenzamide has a molecular weight of 224.23 g/mol, XLogP of 0.66, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminocyclopropyl)-2-fluoro-4-methoxybenzamide is sourced from PubChem (CID 103804989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).