N-methyl-4-(1-methylpiperidin-2-yl)peroxycyclohexan-1-amine

C13H26N2O2 — CID 146290065

IUPACN-methyl-4-(1-methylpiperidin-2-yl)peroxycyclohexan-1-amine
SMILESCNC1CCC(OOC2CCCCN2C)CC1
InChIInChI=1S/C13H26N2O2/c1-14-11-6-8-12(9-7-11)16-17-13-5-3-4-10-15(13)2/h11-14H,3-10H2,1-2H3
InChIKeyZMVHYAWMIREFHW-UHFFFAOYSA-N
MW242.36 g/mol
LogP1.91
Rot. Bonds4

About N-methyl-4-(1-methylpiperidin-2-yl)peroxycyclohexan-1-amine

N-methyl-4-(1-methylpiperidin-2-yl)peroxycyclohexan-1-amine (PubChem CID 146290065) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is N-methyl-4-(1-methylpiperidin-2-yl)peroxycyclohexan-1-amine.

Molecular Properties

Compound NameN-methyl-4-(1-methylpiperidin-2-yl)peroxycyclohexan-1-amine
PubChem CID146290065
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC NameN-methyl-4-(1-methylpiperidin-2-yl)peroxycyclohexan-1-amine
SMILESCNC1CCC(OOC2CCCCN2C)CC1
InChIInChI=1S/C13H26N2O2/c1-14-11-6-8-12(9-7-11)16-17-13-5-3-4-10-15(13)2/h11-14H,3-10H2,1-2H3
InChIKeyZMVHYAWMIREFHW-UHFFFAOYSA-N
XLogP1.91
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-methyl-4-(1-methylpiperidin-2-yl)peroxycyclohexan-1-amine 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-methoxy-1-methylpiperidine
CID 23222665
1-methyl-2-(trioxidanyl)pyrrolidine
CID 143169631
1,4-dimethylpiperazine;ethane;N-methylcyclopentanamine
CID 143216901
N-methylcyclotetradecanamine
CID 59468246
N-methylcyclohexanamine
CID 7514
1-methyl-2-pentoxypiperidine
CID 174740855
4-cyclopentyl-N-methylcyclohexan-1-amine
CID 116962729
(2R)-N,1-dimethylpyrrolidin-2-amine
CID 152749682
1-(2-cyclohexyloxyethyl)-N-methylpiperidin-4-amine
CID 63827361
N-methylcyclohexanamine;dihydrochloride
CID 140514199
hydron;N-methylcyclopentanamine;chloride
CID 67156726
4-methoxy-N-[(1-methylpyrrolidin-2-yl)methyl]cyclohexan-1-amine
CID 104530001

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-(1-methylpiperidin-2-yl)peroxycyclohexan-1-amine?
The IUPAC name of N-methyl-4-(1-methylpiperidin-2-yl)peroxycyclohexan-1-amine (CID 146290065) is N-methyl-4-(1-methylpiperidin-2-yl)peroxycyclohexan-1-amine.
What is the SMILES notation for N-methyl-4-(1-methylpiperidin-2-yl)peroxycyclohexan-1-amine?
The canonical SMILES for N-methyl-4-(1-methylpiperidin-2-yl)peroxycyclohexan-1-amine is CNC1CCC(OOC2CCCCN2C)CC1.
What is the InChIKey of N-methyl-4-(1-methylpiperidin-2-yl)peroxycyclohexan-1-amine?
The InChIKey is ZMVHYAWMIREFHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-14-11-6-8-12(9-7-11)16-17-13-5-3-4-10-15(13)2/h11-14H,3-10H2,1-2H3.
What are the key properties of N-methyl-4-(1-methylpiperidin-2-yl)peroxycyclohexan-1-amine?
N-methyl-4-(1-methylpiperidin-2-yl)peroxycyclohexan-1-amine has a molecular weight of 242.36 g/mol, XLogP of 1.91, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-(1-methylpiperidin-2-yl)peroxycyclohexan-1-amine is sourced from PubChem (CID 146290065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).