(Z)-N-ethyl-3,3-dimethylnon-5-en-4-imine

C13H25N — CID 91085626

IUPAC(Z)-N-ethyl-3,3-dimethylnon-5-en-4-imine
SMILESCCC/C=C\C(=N/CC)C(C)(C)CC
InChIInChI=1S/C13H25N/c1-6-9-10-11-12(14-8-3)13(4,5)7-2/h10-11H,6-9H2,1-5H3/b11-10-,14-12+
InChIKeyLYUIMOQFWWZTQL-HSINTONASA-N
MW195.35 g/mol
LogP4.24
Rot. Bonds6

About (Z)-N-ethyl-3,3-dimethylnon-5-en-4-imine

(Z)-N-ethyl-3,3-dimethylnon-5-en-4-imine (PubChem CID 91085626) has the molecular formula C13H25N and a molecular weight of 195.35 g/mol. Its IUPAC name is (Z)-N-ethyl-3,3-dimethylnon-5-en-4-imine.

Molecular Properties

Compound Name(Z)-N-ethyl-3,3-dimethylnon-5-en-4-imine
PubChem CID91085626
Molecular FormulaC13H25N
Molecular Weight195.35 g/mol
Exact Mass195.20
IUPAC Name(Z)-N-ethyl-3,3-dimethylnon-5-en-4-imine
SMILESCCC/C=C\C(=N/CC)C(C)(C)CC
InChIInChI=1S/C13H25N/c1-6-9-10-11-12(14-8-3)13(4,5)7-2/h10-11H,6-9H2,1-5H3/b11-10-,14-12+
InChIKeyLYUIMOQFWWZTQL-HSINTONASA-N
XLogP4.24
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.35
LogP ≤ 54.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

6-(2-Methylbutan-2-yl)-3-(trifluoromethyl)-2,3-dihydropyridine
CID 148840340
Ethyl-(3,5,5-trimethyl-cyclohex-2-enylidene)-amine
CID 11205971
3,5,5-trimethyl-N-(2-methylpropyl)cyclohex-2-en-1-imine
CID 70516911
N,2,5,5-tetramethylcyclohex-2-en-1-imine
CID 86038796
6-[(2S)-butan-2-yl]-3-fluoro-2,3-dihydropyridine
CID 144060408
(1Z)-3,5,5-Trimethyl-N-(prop-2-en-1-yl)cyclohex-2-en-1-imine
CID 238062
2,5-ditert-butyl-2H-pyrrole
CID 22374998
5-tert-butyl-2H-pyrrole
CID 57674557
3,5-ditert-butyl-2H-pyrrole
CID 58139020
4-tert-butyl-5-ethenyl-2H-pyrrole
CID 58263748
3,6-Ditert-butyl-2,3-dihydropyridine
CID 58579568
6-Tert-butyl-2,3-dihydropyridine
CID 58674837

Frequently Asked Questions

What is the IUPAC name of (Z)-N-ethyl-3,3-dimethylnon-5-en-4-imine?
The IUPAC name of (Z)-N-ethyl-3,3-dimethylnon-5-en-4-imine (CID 91085626) is (Z)-N-ethyl-3,3-dimethylnon-5-en-4-imine.
What is the SMILES notation for (Z)-N-ethyl-3,3-dimethylnon-5-en-4-imine?
The canonical SMILES for (Z)-N-ethyl-3,3-dimethylnon-5-en-4-imine is CCC/C=C\C(=N/CC)C(C)(C)CC.
What is the InChIKey of (Z)-N-ethyl-3,3-dimethylnon-5-en-4-imine?
The InChIKey is LYUIMOQFWWZTQL-HSINTONASA-N. The full InChI is InChI=1S/C13H25N/c1-6-9-10-11-12(14-8-3)13(4,5)7-2/h10-11H,6-9H2,1-5H3/b11-10-,14-12+.
What are the key properties of (Z)-N-ethyl-3,3-dimethylnon-5-en-4-imine?
(Z)-N-ethyl-3,3-dimethylnon-5-en-4-imine has a molecular weight of 195.35 g/mol, XLogP of 4.24, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-ethyl-3,3-dimethylnon-5-en-4-imine is sourced from PubChem (CID 91085626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).