About [methyl-[(4-methylcyclohexyl)methyl]amino]azanide
[methyl-[(4-methylcyclohexyl)methyl]amino]azanide (PubChem CID 163725695) has the molecular formula C9H19N2-
and a molecular weight of 155.27 g/mol. Its IUPAC name is [methyl-[(4-methylcyclohexyl)methyl]amino]azanide.
Molecular Properties
| Compound Name | [methyl-[(4-methylcyclohexyl)methyl]amino]azanide |
| PubChem CID | 163725695 |
| Molecular Formula | C9H19N2- |
| Molecular Weight | 155.27 g/mol |
| Exact Mass | 155.16 |
| IUPAC Name | [methyl-[(4-methylcyclohexyl)methyl]amino]azanide |
| SMILES | CC1CCC(CN(C)[NH-])CC1 |
| InChI | InChI=1S/C9H19N2/c1-8-3-5-9(6-4-8)7-11(2)10/h8-10H,3-7H2,1-2H3/q-1 |
| InChIKey | KUSYZDSBYRNUKI-UHFFFAOYSA-N |
| XLogP | 2.71 |
| TPSA | 27.04 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 11 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 155.27 |
| LogP ≤ 5 | 2.71 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
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 [methyl-[(4-methylcyclohexyl)methyl]amino]azanide?
The IUPAC name of [methyl-[(4-methylcyclohexyl)methyl]amino]azanide (CID 163725695) is [methyl-[(4-methylcyclohexyl)methyl]amino]azanide.
What is the SMILES notation for [methyl-[(4-methylcyclohexyl)methyl]amino]azanide?
The canonical SMILES for [methyl-[(4-methylcyclohexyl)methyl]amino]azanide is CC1CCC(CN(C)[NH-])CC1.
What is the InChIKey of [methyl-[(4-methylcyclohexyl)methyl]amino]azanide?
The InChIKey is KUSYZDSBYRNUKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N2/c1-8-3-5-9(6-4-8)7-11(2)10/h8-10H,3-7H2,1-2H3/q-1.
What are the key properties of [methyl-[(4-methylcyclohexyl)methyl]amino]azanide?
[methyl-[(4-methylcyclohexyl)methyl]amino]azanide has a molecular weight of 155.27 g/mol, XLogP of 2.71, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [methyl-[(4-methylcyclohexyl)methyl]amino]azanide is sourced from PubChem (CID 163725695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).