dichloromethane;2-methoxy-N-methylethanamine

C5H13Cl2NO — CID 131725176

IUPACdichloromethane;2-methoxy-N-methylethanamine
SMILESCNCCOC.ClCCl
InChIInChI=1S/C4H11NO.CH2Cl2/c1-5-3-4-6-2;2-1-3/h5H,3-4H2,1-2H3;1H2
InChIKeyXNLFPFVHMOSEQS-UHFFFAOYSA-N
MW174.07 g/mol
LogP1.27
Rot. Bonds3

About dichloromethane;2-methoxy-N-methylethanamine

dichloromethane;2-methoxy-N-methylethanamine (PubChem CID 131725176) has the molecular formula C5H13Cl2NO and a molecular weight of 174.07 g/mol. Its IUPAC name is dichloromethane;2-methoxy-N-methylethanamine.

Molecular Properties

Compound Namedichloromethane;2-methoxy-N-methylethanamine
PubChem CID131725176
Molecular FormulaC5H13Cl2NO
Molecular Weight174.07 g/mol
Exact Mass173.04
IUPAC Namedichloromethane;2-methoxy-N-methylethanamine
SMILESCNCCOC.ClCCl
InChIInChI=1S/C4H11NO.CH2Cl2/c1-5-3-4-6-2;2-1-3/h5H,3-4H2,1-2H3;1H2
InChIKeyXNLFPFVHMOSEQS-UHFFFAOYSA-N
XLogP1.27
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.07
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

ethane;2-methoxy-N-methylethanamine
CID 91504059
methane;2-methoxy-N-methylethanamine
CID 159300149
2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-N-methylethanamine
CID 86705991
2-[2-(2-methoxyethoxy)ethoxy]-N-methylethanamine;1-methoxy-2-(2-methoxyethoxy)ethane
CID 168897586
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-N-methylethanamine
CID 146502176
carbamodithioic acid;2-methoxy-N-methylethanamine
CID 174232008
ethane;2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-N-methylethanamine
CID 163400177
2-[2-(4-methoxybutoxy)ethoxy]-N-methylethanamine
CID 135175798
N-(2-chloroethyl)-2-methoxyethanamine
CID 64980906
2-(2-methoxyethylsulfonyl)-N-methylethanamine
CID 64646513
tert-butyl formate;ethane;2-methoxy-N-methylethanamine
CID 144580740
1,2-dimethoxyethane;N-methylmethanamine
CID 175177446

Frequently Asked Questions

What is the IUPAC name of dichloromethane;2-methoxy-N-methylethanamine?
The IUPAC name of dichloromethane;2-methoxy-N-methylethanamine (CID 131725176) is dichloromethane;2-methoxy-N-methylethanamine.
What is the SMILES notation for dichloromethane;2-methoxy-N-methylethanamine?
The canonical SMILES for dichloromethane;2-methoxy-N-methylethanamine is CNCCOC.ClCCl.
What is the InChIKey of dichloromethane;2-methoxy-N-methylethanamine?
The InChIKey is XNLFPFVHMOSEQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11NO.CH2Cl2/c1-5-3-4-6-2;2-1-3/h5H,3-4H2,1-2H3;1H2.
What are the key properties of dichloromethane;2-methoxy-N-methylethanamine?
dichloromethane;2-methoxy-N-methylethanamine has a molecular weight of 174.07 g/mol, XLogP of 1.27, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dichloromethane;2-methoxy-N-methylethanamine is sourced from PubChem (CID 131725176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).