4-[(dimethylhydrazinylidene)methyl]-N,N-diethyl-3,5-dimethylcyclohexan-1-amine

C15H31N3 — CID 154595530

IUPAC4-[(dimethylhydrazinylidene)methyl]-N,N-diethyl-3,5-dimethylcyclohexan-1-amine
SMILESCCN(CC)C1CC(C)C(C=NN(C)C)C(C)C1
InChIInChI=1S/C15H31N3/c1-7-18(8-2)14-9-12(3)15(13(4)10-14)11-16-17(5)6/h11-15H,7-10H2,1-6H3
InChIKeyDBNXMWVSGRJNCX-UHFFFAOYSA-N
MW253.43 g/mol
LogP2.93
Rot. Bonds5

About 4-[(dimethylhydrazinylidene)methyl]-N,N-diethyl-3,5-dimethylcyclohexan-1-amine

4-[(dimethylhydrazinylidene)methyl]-N,N-diethyl-3,5-dimethylcyclohexan-1-amine (PubChem CID 154595530) has the molecular formula C15H31N3 and a molecular weight of 253.43 g/mol. Its IUPAC name is 4-[(dimethylhydrazinylidene)methyl]-N,N-diethyl-3,5-dimethylcyclohexan-1-amine.

Molecular Properties

Compound Name4-[(dimethylhydrazinylidene)methyl]-N,N-diethyl-3,5-dimethylcyclohexan-1-amine
PubChem CID154595530
Molecular FormulaC15H31N3
Molecular Weight253.43 g/mol
Exact Mass253.25
IUPAC Name4-[(dimethylhydrazinylidene)methyl]-N,N-diethyl-3,5-dimethylcyclohexan-1-amine
SMILESCCN(CC)C1CC(C)C(C=NN(C)C)C(C)C1
InChIInChI=1S/C15H31N3/c1-7-18(8-2)14-9-12(3)15(13(4)10-14)11-16-17(5)6/h11-15H,7-10H2,1-6H3
InChIKeyDBNXMWVSGRJNCX-UHFFFAOYSA-N
XLogP2.93
TPSA18.84 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.43
LogP ≤ 52.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-[(dimethylhydrazinylidene)methyl]-N,N-diethyl-3,5-dimethylcyclohexan-1-amine?
The IUPAC name of 4-[(dimethylhydrazinylidene)methyl]-N,N-diethyl-3,5-dimethylcyclohexan-1-amine (CID 154595530) is 4-[(dimethylhydrazinylidene)methyl]-N,N-diethyl-3,5-dimethylcyclohexan-1-amine.
What is the SMILES notation for 4-[(dimethylhydrazinylidene)methyl]-N,N-diethyl-3,5-dimethylcyclohexan-1-amine?
The canonical SMILES for 4-[(dimethylhydrazinylidene)methyl]-N,N-diethyl-3,5-dimethylcyclohexan-1-amine is CCN(CC)C1CC(C)C(C=NN(C)C)C(C)C1.
What is the InChIKey of 4-[(dimethylhydrazinylidene)methyl]-N,N-diethyl-3,5-dimethylcyclohexan-1-amine?
The InChIKey is DBNXMWVSGRJNCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3/c1-7-18(8-2)14-9-12(3)15(13(4)10-14)11-16-17(5)6/h11-15H,7-10H2,1-6H3.
What are the key properties of 4-[(dimethylhydrazinylidene)methyl]-N,N-diethyl-3,5-dimethylcyclohexan-1-amine?
4-[(dimethylhydrazinylidene)methyl]-N,N-diethyl-3,5-dimethylcyclohexan-1-amine has a molecular weight of 253.43 g/mol, XLogP of 2.93, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(dimethylhydrazinylidene)methyl]-N,N-diethyl-3,5-dimethylcyclohexan-1-amine is sourced from PubChem (CID 154595530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).