N-[2-(aminomethyl)cyclopentyl]-2-(2-phenoxyethoxy)acetamide;hydrochloride

C16H25ClN2O3 — CID 119600796

IUPACN-[2-(aminomethyl)cyclopentyl]-2-(2-phenoxyethoxy)acetamide;hydrochloride
SMILESCl.NCC1CCCC1NC(=O)COCCOc1ccccc1
InChIInChI=1S/C16H24N2O3.ClH/c17-11-13-5-4-8-15(13)18-16(19)12-20-9-10-21-14-6-2-1-3-7-14;/h1-3,6-7,13,15H,4-5,8-12,17H2,(H,18,19);1H
InChIKeyAQLQBCLXZFOSIR-UHFFFAOYSA-N
MW328.84 g/mol
LogP1.75
Rot. Bonds8

About N-[2-(aminomethyl)cyclopentyl]-2-(2-phenoxyethoxy)acetamide;hydrochloride

N-[2-(aminomethyl)cyclopentyl]-2-(2-phenoxyethoxy)acetamide;hydrochloride (PubChem CID 119600796) has the molecular formula C16H25ClN2O3 and a molecular weight of 328.84 g/mol. Its IUPAC name is N-[2-(aminomethyl)cyclopentyl]-2-(2-phenoxyethoxy)acetamide;hydrochloride.

Molecular Properties

Compound NameN-[2-(aminomethyl)cyclopentyl]-2-(2-phenoxyethoxy)acetamide;hydrochloride
PubChem CID119600796
Molecular FormulaC16H25ClN2O3
Molecular Weight328.84 g/mol
Exact Mass328.16
IUPAC NameN-[2-(aminomethyl)cyclopentyl]-2-(2-phenoxyethoxy)acetamide;hydrochloride
SMILESCl.NCC1CCCC1NC(=O)COCCOc1ccccc1
InChIInChI=1S/C16H24N2O3.ClH/c17-11-13-5-4-8-15(13)18-16(19)12-20-9-10-21-14-6-2-1-3-7-14;/h1-3,6-7,13,15H,4-5,8-12,17H2,(H,18,19);1H
InChIKeyAQLQBCLXZFOSIR-UHFFFAOYSA-N
XLogP1.75
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.84
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-[2-(aminomethyl)cyclopentyl]-2-(2-phenoxyethoxy)acetamide;hydrochloride 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)cyclopentyl]-2-phenoxyacetamide;hydrochloride
CID 119601101
N-[2-(aminomethyl)cyclohexyl]-2-(4-propoxyphenoxy)acetamide
CID 119609351
2-(2-phenoxyethoxy)-N-[(1R,2R,6R,7S,8R)-8-tricyclo[5.2.1.02,6]decanyl]acetamide
CID 124786370
2-(2-phenoxyethoxy)-N-[(1R,2S,6R,7S,8R)-8-tricyclo[5.2.1.02,6]decanyl]acetamide
CID 124786369
N-[2-(aminomethyl)cyclopentyl]-2-(2-chlorophenoxy)acetamide;hydrochloride
CID 119603021
N-[2-(aminomethyl)cyclohexyl]-2-(4-ethoxyphenoxy)acetamide;hydrochloride
CID 119610949
N-[2-(aminomethyl)cyclopentyl]-2-[2-(2,2,2-trifluoroethoxy)phenoxy]acetamide;hydrochloride
CID 119601561
N-[2-(aminomethyl)cyclopentyl]-2-(3-methylphenoxy)acetamide
CID 119603622
N-[2-(aminomethyl)cyclopentyl]-2-(4-ethylphenoxy)acetamide
CID 119601137
N-[2-(aminomethyl)cyclohexyl]-2-(2-phenylmethoxyphenoxy)acetamide;hydrochloride
CID 119612068
N-[2-(aminomethyl)cyclopentyl]-2-(4-ethoxyphenyl)acetamide;hydrochloride
CID 119600531
N-[2-(aminomethyl)cyclopentyl]-2-(2,6-dimethylphenoxy)acetamide
CID 119605033

Frequently Asked Questions

What is the IUPAC name of N-[2-(aminomethyl)cyclopentyl]-2-(2-phenoxyethoxy)acetamide;hydrochloride?
The IUPAC name of N-[2-(aminomethyl)cyclopentyl]-2-(2-phenoxyethoxy)acetamide;hydrochloride (CID 119600796) is N-[2-(aminomethyl)cyclopentyl]-2-(2-phenoxyethoxy)acetamide;hydrochloride.
What is the SMILES notation for N-[2-(aminomethyl)cyclopentyl]-2-(2-phenoxyethoxy)acetamide;hydrochloride?
The canonical SMILES for N-[2-(aminomethyl)cyclopentyl]-2-(2-phenoxyethoxy)acetamide;hydrochloride is Cl.NCC1CCCC1NC(=O)COCCOc1ccccc1.
What is the InChIKey of N-[2-(aminomethyl)cyclopentyl]-2-(2-phenoxyethoxy)acetamide;hydrochloride?
The InChIKey is AQLQBCLXZFOSIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3.ClH/c17-11-13-5-4-8-15(13)18-16(19)12-20-9-10-21-14-6-2-1-3-7-14;/h1-3,6-7,13,15H,4-5,8-12,17H2,(H,18,19);1H.
What are the key properties of N-[2-(aminomethyl)cyclopentyl]-2-(2-phenoxyethoxy)acetamide;hydrochloride?
N-[2-(aminomethyl)cyclopentyl]-2-(2-phenoxyethoxy)acetamide;hydrochloride has a molecular weight of 328.84 g/mol, XLogP of 1.75, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(aminomethyl)cyclopentyl]-2-(2-phenoxyethoxy)acetamide;hydrochloride is sourced from PubChem (CID 119600796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).