2-chloro-2-cyclopropyl-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethanamine

C12H24ClNO3 — CID 104567217

IUPAC2-chloro-2-cyclopropyl-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethanamine
SMILESCOCCOCCOCCNCC(Cl)C1CC1
InChIInChI=1S/C12H24ClNO3/c1-15-6-7-17-9-8-16-5-4-14-10-12(13)11-2-3-11/h11-12,14H,2-10H2,1H3
InChIKeyAKFWENAYVWUKBL-UHFFFAOYSA-N
MW265.78 g/mol
LogP1.27
Rot. Bonds12

About 2-chloro-2-cyclopropyl-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethanamine

2-chloro-2-cyclopropyl-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethanamine (PubChem CID 104567217) has the molecular formula C12H24ClNO3 and a molecular weight of 265.78 g/mol. Its IUPAC name is 2-chloro-2-cyclopropyl-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethanamine.

Molecular Properties

Compound Name2-chloro-2-cyclopropyl-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethanamine
PubChem CID104567217
Molecular FormulaC12H24ClNO3
Molecular Weight265.78 g/mol
Exact Mass265.14
IUPAC Name2-chloro-2-cyclopropyl-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethanamine
SMILESCOCCOCCOCCNCC(Cl)C1CC1
InChIInChI=1S/C12H24ClNO3/c1-15-6-7-17-9-8-16-5-4-14-10-12(13)11-2-3-11/h11-12,14H,2-10H2,1H3
InChIKeyAKFWENAYVWUKBL-UHFFFAOYSA-N
XLogP1.27
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds12
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.78
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-chloro-2-cyclopropyl-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethanamine 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-dicyclopropyl-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethanamine
CID 104562462
2-chloro-N-[2-(2-methoxyethoxy)ethyl]-4-methylpentan-1-amine
CID 107155875
N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-2-methylbutan-1-amine
CID 104562209
1-cyclopropyl-N-[2-(2-methoxyethoxy)ethyl]-2-methylpropan-1-amine
CID 115712459
[1-chloro-5-(2-methoxyethoxy)pentyl]cyclopentane
CID 103411923
1-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-2-N,2-N-dimethylpropane-1,2-diamine
CID 104562097
3-chloro-4-methoxy-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]butan-1-amine
CID 106242330
2-methoxy-N-[2-[2-[2-[2-[2-(2-methoxyethylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethyl]ethanamine
CID 102574909
bis(1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane);2-methoxy-N-(2-methoxyethyl)ethanamine
CID 87204076
N-(2-chloroethyl)-2-[2-(2-methoxyethoxy)ethoxy]ethanamine
CID 104567151
N-[3-[2-(2-methoxyethoxy)ethoxy]propyl]-2-methylpropan-1-amine
CID 104560835
methyl 2-chloro-3-[3-(2-methoxyethoxy)propylamino]propanoate
CID 103491945

Frequently Asked Questions

What is the IUPAC name of 2-chloro-2-cyclopropyl-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethanamine?
The IUPAC name of 2-chloro-2-cyclopropyl-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethanamine (CID 104567217) is 2-chloro-2-cyclopropyl-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethanamine.
What is the SMILES notation for 2-chloro-2-cyclopropyl-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethanamine?
The canonical SMILES for 2-chloro-2-cyclopropyl-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethanamine is COCCOCCOCCNCC(Cl)C1CC1.
What is the InChIKey of 2-chloro-2-cyclopropyl-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethanamine?
The InChIKey is AKFWENAYVWUKBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24ClNO3/c1-15-6-7-17-9-8-16-5-4-14-10-12(13)11-2-3-11/h11-12,14H,2-10H2,1H3.
What are the key properties of 2-chloro-2-cyclopropyl-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethanamine?
2-chloro-2-cyclopropyl-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethanamine has a molecular weight of 265.78 g/mol, XLogP of 1.27, 12 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-2-cyclopropyl-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethanamine is sourced from PubChem (CID 104567217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).