N-(3-aminopropyl)-2-methoxyacetamide;hydrochloride

C6H15ClN2O2 — CID 154747260

IUPACN-(3-aminopropyl)-2-methoxyacetamide;hydrochloride
SMILESCOCC(=O)NCCCN.Cl
InChIInChI=1S/C6H14N2O2.ClH/c1-10-5-6(9)8-4-2-3-7;/h2-5,7H2,1H3,(H,8,9);1H
InChIKeyNFRRKLFCLUQTEW-UHFFFAOYSA-N
MW182.65 g/mol
LogP-0.48
Rot. Bonds5

About N-(3-aminopropyl)-2-methoxyacetamide;hydrochloride

N-(3-aminopropyl)-2-methoxyacetamide;hydrochloride (PubChem CID 154747260) has the molecular formula C6H15ClN2O2 and a molecular weight of 182.65 g/mol. Its IUPAC name is N-(3-aminopropyl)-2-methoxyacetamide;hydrochloride.

Molecular Properties

Compound NameN-(3-aminopropyl)-2-methoxyacetamide;hydrochloride
PubChem CID154747260
Molecular FormulaC6H15ClN2O2
Molecular Weight182.65 g/mol
Exact Mass182.08
IUPAC NameN-(3-aminopropyl)-2-methoxyacetamide;hydrochloride
SMILESCOCC(=O)NCCCN.Cl
InChIInChI=1S/C6H14N2O2.ClH/c1-10-5-6(9)8-4-2-3-7;/h2-5,7H2,1H3,(H,8,9);1H
InChIKeyNFRRKLFCLUQTEW-UHFFFAOYSA-N
XLogP-0.48
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.65
LogP ≤ 5-0.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-(3-aminopropyl)-2-methoxyacetamide;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-[3-(4-aminobutylamino)propyl]-2-methoxyacetamide;hydrochloride
CID 118721810
3-amino-N-(2-methoxyethyl)propanamide
CID 16783560
6-(Aminomethyl)morpholin-3-one hydrochloride
CID 22612261
N-(4-aminobutyl)-2-methoxyacetamide;hydrochloride
CID 118721808
N-[4-(3-aminopropylamino)butyl]-2-methoxyacetamide;hydrochloride
CID 118721813
N-(4-aminobutyl)-N-(3-aminopropyl)-2-methoxyacetamide;hydrochloride
CID 118721816
3-Amino-N-(2-methoxyethyl)propanamide hydrochloride
CID 56832081
1-[3-(Aminomethyl)azetidin-1-yl]-2-methoxyethan-1-one hydrochloride
CID 86775412
N-(2-aminoethyl)-2-methoxyacetamide hydrochloride
CID 137935379
N-(2-aminoethyl)-2-ethoxyacetamide hydrochloride
CID 137943832
N-butyl-2-methoxyacetamide
CID 13708111
2-Methoxy-N-(propan-2-yl)acetamide
CID 19353620

Frequently Asked Questions

What is the IUPAC name of N-(3-aminopropyl)-2-methoxyacetamide;hydrochloride?
The IUPAC name of N-(3-aminopropyl)-2-methoxyacetamide;hydrochloride (CID 154747260) is N-(3-aminopropyl)-2-methoxyacetamide;hydrochloride.
What is the SMILES notation for N-(3-aminopropyl)-2-methoxyacetamide;hydrochloride?
The canonical SMILES for N-(3-aminopropyl)-2-methoxyacetamide;hydrochloride is COCC(=O)NCCCN.Cl.
What is the InChIKey of N-(3-aminopropyl)-2-methoxyacetamide;hydrochloride?
The InChIKey is NFRRKLFCLUQTEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O2.ClH/c1-10-5-6(9)8-4-2-3-7;/h2-5,7H2,1H3,(H,8,9);1H.
What are the key properties of N-(3-aminopropyl)-2-methoxyacetamide;hydrochloride?
N-(3-aminopropyl)-2-methoxyacetamide;hydrochloride has a molecular weight of 182.65 g/mol, XLogP of -0.48, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminopropyl)-2-methoxyacetamide;hydrochloride is sourced from PubChem (CID 154747260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).