N-[2-(aminomethyl)cyclohexyl]-2-(2,4-difluorophenoxy)acetamide

C15H20F2N2O2 — CID 119610188

IUPACN-[2-(aminomethyl)cyclohexyl]-2-(2,4-difluorophenoxy)acetamide
SMILESNCC1CCCCC1NC(=O)COc1ccc(F)cc1F
InChIInChI=1S/C15H20F2N2O2/c16-11-5-6-14(12(17)7-11)21-9-15(20)19-13-4-2-1-3-10(13)8-18/h5-7,10,13H,1-4,8-9,18H2,(H,19,20)
InChIKeyIMAXAHABKGHFST-UHFFFAOYSA-N
MW298.33 g/mol
LogP1.98
Rot. Bonds5

About N-[2-(aminomethyl)cyclohexyl]-2-(2,4-difluorophenoxy)acetamide

N-[2-(aminomethyl)cyclohexyl]-2-(2,4-difluorophenoxy)acetamide (PubChem CID 119610188) has the molecular formula C15H20F2N2O2 and a molecular weight of 298.33 g/mol. Its IUPAC name is N-[2-(aminomethyl)cyclohexyl]-2-(2,4-difluorophenoxy)acetamide.

Molecular Properties

Compound NameN-[2-(aminomethyl)cyclohexyl]-2-(2,4-difluorophenoxy)acetamide
PubChem CID119610188
Molecular FormulaC15H20F2N2O2
Molecular Weight298.33 g/mol
Exact Mass298.15
IUPAC NameN-[2-(aminomethyl)cyclohexyl]-2-(2,4-difluorophenoxy)acetamide
SMILESNCC1CCCCC1NC(=O)COc1ccc(F)cc1F
InChIInChI=1S/C15H20F2N2O2/c16-11-5-6-14(12(17)7-11)21-9-15(20)19-13-4-2-1-3-10(13)8-18/h5-7,10,13H,1-4,8-9,18H2,(H,19,20)
InChIKeyIMAXAHABKGHFST-UHFFFAOYSA-N
XLogP1.98
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.33
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[2-(aminomethyl)cyclohexyl]-2-(2,4-difluorophenoxy)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-(aminomethyl)cyclohexyl]-2-(2,5-dimethylphenoxy)acetamide
CID 119611347
N-[2-(aminomethyl)cyclopentyl]-2-[2-(2,2,2-trifluoroethoxy)phenoxy]acetamide;hydrochloride
CID 119601561
N-[2-(aminomethyl)cyclopentyl]-2-(4-chloro-2-methylphenoxy)acetamide;hydrochloride
CID 119600494
N-[2-(aminomethyl)cyclohexyl]-2-(3-fluoro-4-methoxyphenyl)acetamide;hydrochloride
CID 119609283
2-(2-chloro-4-fluorophenoxy)-N-[2-(hydroxymethyl)cyclopentyl]acetamide
CID 103774298
N-[2-(aminomethyl)cyclopentyl]-2-(2,5-dichlorophenoxy)acetamide;hydrochloride
CID 119600602
N-[2-(aminomethyl)cyclohexyl]-2-(2-phenylmethoxyphenoxy)acetamide;hydrochloride
CID 119612068
N-[2-(aminomethyl)cyclopentyl]-2-(2-chlorophenoxy)acetamide;hydrochloride
CID 119603021
cis-(1S,3R)-3-[[2-(2,4-difluorophenoxy)acetyl]amino]cyclopentane-1-carboxylic acid
CID 120675579
N-[2-(aminomethyl)cyclohexyl]-2-[4-(trifluoromethyl)phenoxy]acetamide
CID 119611391
2-(2-fluorophenoxy)-N-(2-hydroxycyclohexyl)acetamide
CID 62360872
N-[2-(aminomethyl)cyclopentyl]-4-(2-fluorophenoxy)butanamide;hydrochloride
CID 119603939

Frequently Asked Questions

What is the IUPAC name of N-[2-(aminomethyl)cyclohexyl]-2-(2,4-difluorophenoxy)acetamide?
The IUPAC name of N-[2-(aminomethyl)cyclohexyl]-2-(2,4-difluorophenoxy)acetamide (CID 119610188) is N-[2-(aminomethyl)cyclohexyl]-2-(2,4-difluorophenoxy)acetamide.
What is the SMILES notation for N-[2-(aminomethyl)cyclohexyl]-2-(2,4-difluorophenoxy)acetamide?
The canonical SMILES for N-[2-(aminomethyl)cyclohexyl]-2-(2,4-difluorophenoxy)acetamide is NCC1CCCCC1NC(=O)COc1ccc(F)cc1F.
What is the InChIKey of N-[2-(aminomethyl)cyclohexyl]-2-(2,4-difluorophenoxy)acetamide?
The InChIKey is IMAXAHABKGHFST-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20F2N2O2/c16-11-5-6-14(12(17)7-11)21-9-15(20)19-13-4-2-1-3-10(13)8-18/h5-7,10,13H,1-4,8-9,18H2,(H,19,20).
What are the key properties of N-[2-(aminomethyl)cyclohexyl]-2-(2,4-difluorophenoxy)acetamide?
N-[2-(aminomethyl)cyclohexyl]-2-(2,4-difluorophenoxy)acetamide has a molecular weight of 298.33 g/mol, XLogP of 1.98, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(aminomethyl)cyclohexyl]-2-(2,4-difluorophenoxy)acetamide is sourced from PubChem (CID 119610188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).