1-(2-chlorophenyl)-N-methoxymethanamine;hydrochloride

C8H11Cl2NO — CID 119031737

IUPAC1-(2-chlorophenyl)-N-methoxymethanamine;hydrochloride
SMILESCONCc1ccccc1Cl.Cl
InChIInChI=1S/C8H10ClNO.ClH/c1-11-10-6-7-4-2-3-5-8(7)9;/h2-5,10H,6H2,1H3;1H
InChIKeyHDIWOYPIRIQUPL-UHFFFAOYSA-N
MW208.09 g/mol
LogP2.41
Rot. Bonds3

About 1-(2-chlorophenyl)-N-methoxymethanamine;hydrochloride

1-(2-chlorophenyl)-N-methoxymethanamine;hydrochloride (PubChem CID 119031737) has the molecular formula C8H11Cl2NO and a molecular weight of 208.09 g/mol. Its IUPAC name is 1-(2-chlorophenyl)-N-methoxymethanamine;hydrochloride.

Molecular Properties

Compound Name1-(2-chlorophenyl)-N-methoxymethanamine;hydrochloride
PubChem CID119031737
Molecular FormulaC8H11Cl2NO
Molecular Weight208.09 g/mol
Exact Mass207.02
IUPAC Name1-(2-chlorophenyl)-N-methoxymethanamine;hydrochloride
SMILESCONCc1ccccc1Cl.Cl
InChIInChI=1S/C8H10ClNO.ClH/c1-11-10-6-7-4-2-3-5-8(7)9;/h2-5,10H,6H2,1H3;1H
InChIKeyHDIWOYPIRIQUPL-UHFFFAOYSA-N
XLogP2.41
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.09
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(2-chlorophenyl)-N-methoxymethanamine;hydrochloride?
The IUPAC name of 1-(2-chlorophenyl)-N-methoxymethanamine;hydrochloride (CID 119031737) is 1-(2-chlorophenyl)-N-methoxymethanamine;hydrochloride.
What is the SMILES notation for 1-(2-chlorophenyl)-N-methoxymethanamine;hydrochloride?
The canonical SMILES for 1-(2-chlorophenyl)-N-methoxymethanamine;hydrochloride is CONCc1ccccc1Cl.Cl.
What is the InChIKey of 1-(2-chlorophenyl)-N-methoxymethanamine;hydrochloride?
The InChIKey is HDIWOYPIRIQUPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10ClNO.ClH/c1-11-10-6-7-4-2-3-5-8(7)9;/h2-5,10H,6H2,1H3;1H.
What are the key properties of 1-(2-chlorophenyl)-N-methoxymethanamine;hydrochloride?
1-(2-chlorophenyl)-N-methoxymethanamine;hydrochloride has a molecular weight of 208.09 g/mol, XLogP of 2.41, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chlorophenyl)-N-methoxymethanamine;hydrochloride is sourced from PubChem (CID 119031737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).