4-ethyl-N,N-dimethyloctanimidamide

C12H26N2 — CID 154330119

IUPAC4-ethyl-N,N-dimethyloctanimidamide
SMILES[H]/N=C(/CCC(CC)CCCC)N(C)C
InChIInChI=1S/C12H26N2/c1-5-7-8-11(6-2)9-10-12(13)14(3)4/h11,13H,5-10H2,1-4H3/b13-12-
InChIKeyGRXQEZDECBEWBL-SEYXRHQNSA-N
MW198.35 g/mol
LogP3.52
Rot. Bonds7

About 4-ethyl-N,N-dimethyloctanimidamide

4-ethyl-N,N-dimethyloctanimidamide (PubChem CID 154330119) has the molecular formula C12H26N2 and a molecular weight of 198.35 g/mol. Its IUPAC name is 4-ethyl-N,N-dimethyloctanimidamide.

Molecular Properties

Compound Name4-ethyl-N,N-dimethyloctanimidamide
PubChem CID154330119
Molecular FormulaC12H26N2
Molecular Weight198.35 g/mol
Exact Mass198.21
IUPAC Name4-ethyl-N,N-dimethyloctanimidamide
SMILES[H]/N=C(/CCC(CC)CCCC)N(C)C
InChIInChI=1S/C12H26N2/c1-5-7-8-11(6-2)9-10-12(13)14(3)4/h11,13H,5-10H2,1-4H3/b13-12-
InChIKeyGRXQEZDECBEWBL-SEYXRHQNSA-N
XLogP3.52
TPSA27.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.35
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

5-ethyl-2-methylnon-1-ene
CID 23205953
2-hydroxy-N,N-dimethylhexanimidamide
CID 123619138
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2-ethyl-N,N-bis(2-ethylhexyl)hexan-1-amine;hydrochloride
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2-(2-ethylhexyl)-1,1-dimethylhydrazine
CID 83014664
3-[2-ethylhexyl(2-methoxyethyl)amino]propanimidamide
CID 63286211
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7-ethylundecan-3-one
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20-ethyl-N,N-dimethyltetracosan-1-amine;hydrochloride
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7-ethyltetracosane
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CID 529902

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N,N-dimethyloctanimidamide?
The IUPAC name of 4-ethyl-N,N-dimethyloctanimidamide (CID 154330119) is 4-ethyl-N,N-dimethyloctanimidamide.
What is the SMILES notation for 4-ethyl-N,N-dimethyloctanimidamide?
The canonical SMILES for 4-ethyl-N,N-dimethyloctanimidamide is [H]/N=C(/CCC(CC)CCCC)N(C)C.
What is the InChIKey of 4-ethyl-N,N-dimethyloctanimidamide?
The InChIKey is GRXQEZDECBEWBL-SEYXRHQNSA-N. The full InChI is InChI=1S/C12H26N2/c1-5-7-8-11(6-2)9-10-12(13)14(3)4/h11,13H,5-10H2,1-4H3/b13-12-.
What are the key properties of 4-ethyl-N,N-dimethyloctanimidamide?
4-ethyl-N,N-dimethyloctanimidamide has a molecular weight of 198.35 g/mol, XLogP of 3.52, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N,N-dimethyloctanimidamide is sourced from PubChem (CID 154330119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).