1-(cyclododecylideneamino)oxy-N,N-dimethylpropan-1-amine

C17H34N2O — CID 20572574

IUPAC1-(cyclododecylideneamino)oxy-N,N-dimethylpropan-1-amine
SMILESCCC(ON=C1CCCCCCCCCCC1)N(C)C
InChIInChI=1S/C17H34N2O/c1-4-17(19(2)3)20-18-16-14-12-10-8-6-5-7-9-11-13-15-16/h17H,4-15H2,1-3H3
InChIKeyCNMTZXZATJKCOV-UHFFFAOYSA-N
MW282.47 g/mol
LogP4.96
Rot. Bonds4

About 1-(cyclododecylideneamino)oxy-N,N-dimethylpropan-1-amine

1-(cyclododecylideneamino)oxy-N,N-dimethylpropan-1-amine (PubChem CID 20572574) has the molecular formula C17H34N2O and a molecular weight of 282.47 g/mol. Its IUPAC name is 1-(cyclododecylideneamino)oxy-N,N-dimethylpropan-1-amine.

Molecular Properties

Compound Name1-(cyclododecylideneamino)oxy-N,N-dimethylpropan-1-amine
PubChem CID20572574
Molecular FormulaC17H34N2O
Molecular Weight282.47 g/mol
Exact Mass282.27
IUPAC Name1-(cyclododecylideneamino)oxy-N,N-dimethylpropan-1-amine
SMILESCCC(ON=C1CCCCCCCCCCC1)N(C)C
InChIInChI=1S/C17H34N2O/c1-4-17(19(2)3)20-18-16-14-12-10-8-6-5-7-9-11-13-15-16/h17H,4-15H2,1-3H3
InChIKeyCNMTZXZATJKCOV-UHFFFAOYSA-N
XLogP4.96
TPSA24.83 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.47
LogP ≤ 54.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-(Dimethylamino-propoxyimino)cyclododecane
CID 13205801
1-(Dimethylamino-ethoxyimino)cyclododecane
CID 13205802
1-(Diethylamino-ethoxyimino)cyclododecane
CID 13205803
3-(cyclododecylideneamino)oxy-N,N,2-trimethylpropan-1-amine
CID 13205804
1-(Diisopropylamino-ethoxyimino)cyclododecane
CID 13205805
N-[3-(4-methylpiperazin-1-yl)propoxy]cyclododecanimine
CID 13205807
N-[3-(cyclododecylideneamino)oxypropyl]-N-methylcyclohexanamine
CID 13205809
1-(Diethylamino-propoxyimino)cyclododecane
CID 13205810
3-(cyclododecylideneamino)oxy-N,N-diethyl-2-methylpropan-1-amine
CID 13205811
1-(Diisopropylamino-propoxyimino)cyclododecane
CID 13205812
1-(cyclododecylideneamino)oxy-N,N-diethylethanamine
CID 20572583
1-(cyclododecylideneamino)oxy-N,N-di(propan-2-yl)propan-1-amine
CID 20572586

Frequently Asked Questions

What is the IUPAC name of 1-(cyclododecylideneamino)oxy-N,N-dimethylpropan-1-amine?
The IUPAC name of 1-(cyclododecylideneamino)oxy-N,N-dimethylpropan-1-amine (CID 20572574) is 1-(cyclododecylideneamino)oxy-N,N-dimethylpropan-1-amine.
What is the SMILES notation for 1-(cyclododecylideneamino)oxy-N,N-dimethylpropan-1-amine?
The canonical SMILES for 1-(cyclododecylideneamino)oxy-N,N-dimethylpropan-1-amine is CCC(ON=C1CCCCCCCCCCC1)N(C)C.
What is the InChIKey of 1-(cyclododecylideneamino)oxy-N,N-dimethylpropan-1-amine?
The InChIKey is CNMTZXZATJKCOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O/c1-4-17(19(2)3)20-18-16-14-12-10-8-6-5-7-9-11-13-15-16/h17H,4-15H2,1-3H3.
What are the key properties of 1-(cyclododecylideneamino)oxy-N,N-dimethylpropan-1-amine?
1-(cyclododecylideneamino)oxy-N,N-dimethylpropan-1-amine has a molecular weight of 282.47 g/mol, XLogP of 4.96, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclododecylideneamino)oxy-N,N-dimethylpropan-1-amine is sourced from PubChem (CID 20572574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).