1-cyclohexyl-N-methoxymethanamine;hydrochloride

C8H18ClNO — CID 119031740

IUPAC1-cyclohexyl-N-methoxymethanamine;hydrochloride
SMILESCONCC1CCCCC1.Cl
InChIInChI=1S/C8H17NO.ClH/c1-10-9-7-8-5-3-2-4-6-8;/h8-9H,2-7H2,1H3;1H
InChIKeyFHJBXWZVFDBRQD-UHFFFAOYSA-N
MW179.69 g/mol
LogP2.14
Rot. Bonds3

About 1-cyclohexyl-N-methoxymethanamine;hydrochloride

1-cyclohexyl-N-methoxymethanamine;hydrochloride (PubChem CID 119031740) has the molecular formula C8H18ClNO and a molecular weight of 179.69 g/mol. Its IUPAC name is 1-cyclohexyl-N-methoxymethanamine;hydrochloride.

Molecular Properties

Compound Name1-cyclohexyl-N-methoxymethanamine;hydrochloride
PubChem CID119031740
Molecular FormulaC8H18ClNO
Molecular Weight179.69 g/mol
Exact Mass179.11
IUPAC Name1-cyclohexyl-N-methoxymethanamine;hydrochloride
SMILESCONCC1CCCCC1.Cl
InChIInChI=1S/C8H17NO.ClH/c1-10-9-7-8-5-3-2-4-6-8;/h8-9H,2-7H2,1H3;1H
InChIKeyFHJBXWZVFDBRQD-UHFFFAOYSA-N
XLogP2.14
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.69
LogP ≤ 52.14
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-cyclohexyl-N-methoxymethanamine;hydrochloride?
The IUPAC name of 1-cyclohexyl-N-methoxymethanamine;hydrochloride (CID 119031740) is 1-cyclohexyl-N-methoxymethanamine;hydrochloride.
What is the SMILES notation for 1-cyclohexyl-N-methoxymethanamine;hydrochloride?
The canonical SMILES for 1-cyclohexyl-N-methoxymethanamine;hydrochloride is CONCC1CCCCC1.Cl.
What is the InChIKey of 1-cyclohexyl-N-methoxymethanamine;hydrochloride?
The InChIKey is FHJBXWZVFDBRQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO.ClH/c1-10-9-7-8-5-3-2-4-6-8;/h8-9H,2-7H2,1H3;1H.
What are the key properties of 1-cyclohexyl-N-methoxymethanamine;hydrochloride?
1-cyclohexyl-N-methoxymethanamine;hydrochloride has a molecular weight of 179.69 g/mol, XLogP of 2.14, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-N-methoxymethanamine;hydrochloride is sourced from PubChem (CID 119031740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).