3-[(2-butylcyclohexylidene)amino]oxy-N,N-dimethylpropan-1-amine

C15H30N2O — CID 3061105

IUPAC3-[(2-butylcyclohexylidene)amino]oxy-N,N-dimethylpropan-1-amine
SMILESCCCCC1CCCCC1=NOCCCN(C)C
InChIInChI=1S/C15H30N2O/c1-4-5-9-14-10-6-7-11-15(14)16-18-13-8-12-17(2)3/h14H,4-13H2,1-3H3
InChIKeyZXMYSVXCIRDNPI-UHFFFAOYSA-N
MW254.42 g/mol
LogP3.69
Rot. Bonds8

About 3-[(2-butylcyclohexylidene)amino]oxy-N,N-dimethylpropan-1-amine

3-[(2-butylcyclohexylidene)amino]oxy-N,N-dimethylpropan-1-amine (PubChem CID 3061105) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is 3-[(2-butylcyclohexylidene)amino]oxy-N,N-dimethylpropan-1-amine.

Molecular Properties

Compound Name3-[(2-butylcyclohexylidene)amino]oxy-N,N-dimethylpropan-1-amine
PubChem CID3061105
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name3-[(2-butylcyclohexylidene)amino]oxy-N,N-dimethylpropan-1-amine
SMILESCCCCC1CCCCC1=NOCCCN(C)C
InChIInChI=1S/C15H30N2O/c1-4-5-9-14-10-6-7-11-15(14)16-18-13-8-12-17(2)3/h14H,4-13H2,1-3H3
InChIKeyZXMYSVXCIRDNPI-UHFFFAOYSA-N
XLogP3.69
TPSA24.83 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 3-[(2-butylcyclohexylidene)amino]oxy-N,N-dimethylpropan-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

Frequently Asked Questions

What is the IUPAC name of 3-[(2-butylcyclohexylidene)amino]oxy-N,N-dimethylpropan-1-amine?
The IUPAC name of 3-[(2-butylcyclohexylidene)amino]oxy-N,N-dimethylpropan-1-amine (CID 3061105) is 3-[(2-butylcyclohexylidene)amino]oxy-N,N-dimethylpropan-1-amine.
What is the SMILES notation for 3-[(2-butylcyclohexylidene)amino]oxy-N,N-dimethylpropan-1-amine?
The canonical SMILES for 3-[(2-butylcyclohexylidene)amino]oxy-N,N-dimethylpropan-1-amine is CCCCC1CCCCC1=NOCCCN(C)C.
What is the InChIKey of 3-[(2-butylcyclohexylidene)amino]oxy-N,N-dimethylpropan-1-amine?
The InChIKey is ZXMYSVXCIRDNPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-4-5-9-14-10-6-7-11-15(14)16-18-13-8-12-17(2)3/h14H,4-13H2,1-3H3.
What are the key properties of 3-[(2-butylcyclohexylidene)amino]oxy-N,N-dimethylpropan-1-amine?
3-[(2-butylcyclohexylidene)amino]oxy-N,N-dimethylpropan-1-amine has a molecular weight of 254.42 g/mol, XLogP of 3.69, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-butylcyclohexylidene)amino]oxy-N,N-dimethylpropan-1-amine is sourced from PubChem (CID 3061105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).