(2Z)-N-ethenyl-2-ethylidene-3-methylnonan-1-imine

C14H25N — CID 146227309

IUPAC(2Z)-N-ethenyl-2-ethylidene-3-methylnonan-1-imine
SMILESC=C/N=C/C(=C\C)C(C)CCCCCC
InChIInChI=1S/C14H25N/c1-5-8-9-10-11-13(4)14(6-2)12-15-7-3/h6-7,12-13H,3,5,8-11H2,1-2,4H3/b14-6+,15-12+
InChIKeyAUGYWAMQXYFOGZ-BUJBXKITSA-N
MW207.36 g/mol
LogP4.75
Rot. Bonds8

About (2Z)-N-ethenyl-2-ethylidene-3-methylnonan-1-imine

(2Z)-N-ethenyl-2-ethylidene-3-methylnonan-1-imine (PubChem CID 146227309) has the molecular formula C14H25N and a molecular weight of 207.36 g/mol. Its IUPAC name is (2Z)-N-ethenyl-2-ethylidene-3-methylnonan-1-imine.

Molecular Properties

Compound Name(2Z)-N-ethenyl-2-ethylidene-3-methylnonan-1-imine
PubChem CID146227309
Molecular FormulaC14H25N
Molecular Weight207.36 g/mol
Exact Mass207.20
IUPAC Name(2Z)-N-ethenyl-2-ethylidene-3-methylnonan-1-imine
SMILESC=C/N=C/C(=C\C)C(C)CCCCCC
InChIInChI=1S/C14H25N/c1-5-8-9-10-11-13(4)14(6-2)12-15-7-3/h6-7,12-13H,3,5,8-11H2,1-2,4H3/b14-6+,15-12+
InChIKeyAUGYWAMQXYFOGZ-BUJBXKITSA-N
XLogP4.75
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.36
LogP ≤ 54.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2Z)-N-ethenyl-2-ethylidene-3-methylnonan-1-imine?
The IUPAC name of (2Z)-N-ethenyl-2-ethylidene-3-methylnonan-1-imine (CID 146227309) is (2Z)-N-ethenyl-2-ethylidene-3-methylnonan-1-imine.
What is the SMILES notation for (2Z)-N-ethenyl-2-ethylidene-3-methylnonan-1-imine?
The canonical SMILES for (2Z)-N-ethenyl-2-ethylidene-3-methylnonan-1-imine is C=C/N=C/C(=C\C)C(C)CCCCCC.
What is the InChIKey of (2Z)-N-ethenyl-2-ethylidene-3-methylnonan-1-imine?
The InChIKey is AUGYWAMQXYFOGZ-BUJBXKITSA-N. The full InChI is InChI=1S/C14H25N/c1-5-8-9-10-11-13(4)14(6-2)12-15-7-3/h6-7,12-13H,3,5,8-11H2,1-2,4H3/b14-6+,15-12+.
What are the key properties of (2Z)-N-ethenyl-2-ethylidene-3-methylnonan-1-imine?
(2Z)-N-ethenyl-2-ethylidene-3-methylnonan-1-imine has a molecular weight of 207.36 g/mol, XLogP of 4.75, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-N-ethenyl-2-ethylidene-3-methylnonan-1-imine is sourced from PubChem (CID 146227309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).