N-[2-(aminomethyl)cyclopentyl]-2-(2-fluorophenoxy)butanamide

C16H23FN2O2 — CID 119605380

IUPACN-[2-(aminomethyl)cyclopentyl]-2-(2-fluorophenoxy)butanamide
SMILESCCC(Oc1ccccc1F)C(=O)NC1CCCC1CN
InChIInChI=1S/C16H23FN2O2/c1-2-14(21-15-9-4-3-7-12(15)17)16(20)19-13-8-5-6-11(13)10-18/h3-4,7,9,11,13-14H,2,5-6,8,10,18H2,1H3,(H,19,20)
InChIKeyGNNBGWNWLAXNPY-UHFFFAOYSA-N
MW294.37 g/mol
LogP2.23
Rot. Bonds6

About N-[2-(aminomethyl)cyclopentyl]-2-(2-fluorophenoxy)butanamide

N-[2-(aminomethyl)cyclopentyl]-2-(2-fluorophenoxy)butanamide (PubChem CID 119605380) has the molecular formula C16H23FN2O2 and a molecular weight of 294.37 g/mol. Its IUPAC name is N-[2-(aminomethyl)cyclopentyl]-2-(2-fluorophenoxy)butanamide.

Molecular Properties

Compound NameN-[2-(aminomethyl)cyclopentyl]-2-(2-fluorophenoxy)butanamide
PubChem CID119605380
Molecular FormulaC16H23FN2O2
Molecular Weight294.37 g/mol
Exact Mass294.17
IUPAC NameN-[2-(aminomethyl)cyclopentyl]-2-(2-fluorophenoxy)butanamide
SMILESCCC(Oc1ccccc1F)C(=O)NC1CCCC1CN
InChIInChI=1S/C16H23FN2O2/c1-2-14(21-15-9-4-3-7-12(15)17)16(20)19-13-8-5-6-11(13)10-18/h3-4,7,9,11,13-14H,2,5-6,8,10,18H2,1H3,(H,19,20)
InChIKeyGNNBGWNWLAXNPY-UHFFFAOYSA-N
XLogP2.23
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.37
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[2-(aminomethyl)cyclopentyl]-2-(2-fluorophenoxy)butanamide 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

2-(2-fluorophenoxy)-N-(1-methylpiperidin-4-yl)butanamide
CID 53286385
2-(2-fluorophenoxy)-N-propan-2-ylbutanamide
CID 53286261
N-[2-(aminomethyl)cyclopentyl]-4-(2-fluorophenoxy)butanamide;hydrochloride
CID 119603939
N-[2-(aminomethyl)cyclopentyl]-2-(2-propan-2-yloxyphenyl)acetamide;hydrochloride
CID 119601537
N-[2-(aminomethyl)cyclopentyl]-2-cyclohexyloxybutanamide
CID 119603538
N-(3-aminopropyl)-2-(2-fluorophenoxy)butanamide;hydrochloride
CID 119409107
N-[2-(aminomethyl)cyclohexyl]-2-(2-bromophenoxy)propanamide
CID 119611217
N-[2-(aminomethyl)cyclohexyl]-2-[2-(trifluoromethyl)phenoxy]propanamide
CID 119611197
N-[2-(aminomethyl)cyclopentyl]-2-(3,4-difluorophenoxy)propanamide;hydrochloride
CID 119601484
(2S)-N-cyclopropyl-2-(2-methoxyphenoxy)butanamide
CID 9172668
(2R)-N-cyclohexyl-2-(2-methoxyphenoxy)butanamide
CID 9172985
N-[2-(aminomethyl)cyclopentyl]-2-(2-butan-2-ylphenoxy)acetamide
CID 119603865

Frequently Asked Questions

What is the IUPAC name of N-[2-(aminomethyl)cyclopentyl]-2-(2-fluorophenoxy)butanamide?
The IUPAC name of N-[2-(aminomethyl)cyclopentyl]-2-(2-fluorophenoxy)butanamide (CID 119605380) is N-[2-(aminomethyl)cyclopentyl]-2-(2-fluorophenoxy)butanamide.
What is the SMILES notation for N-[2-(aminomethyl)cyclopentyl]-2-(2-fluorophenoxy)butanamide?
The canonical SMILES for N-[2-(aminomethyl)cyclopentyl]-2-(2-fluorophenoxy)butanamide is CCC(Oc1ccccc1F)C(=O)NC1CCCC1CN.
What is the InChIKey of N-[2-(aminomethyl)cyclopentyl]-2-(2-fluorophenoxy)butanamide?
The InChIKey is GNNBGWNWLAXNPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23FN2O2/c1-2-14(21-15-9-4-3-7-12(15)17)16(20)19-13-8-5-6-11(13)10-18/h3-4,7,9,11,13-14H,2,5-6,8,10,18H2,1H3,(H,19,20).
What are the key properties of N-[2-(aminomethyl)cyclopentyl]-2-(2-fluorophenoxy)butanamide?
N-[2-(aminomethyl)cyclopentyl]-2-(2-fluorophenoxy)butanamide has a molecular weight of 294.37 g/mol, XLogP of 2.23, 6 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-(2-fluorophenoxy)butanamide is sourced from PubChem (CID 119605380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).