N,4,5,6-tetramethyl-N-propyloct-4-enimidamide

C15H30N2 — CID 123534283

IUPACN,4,5,6-tetramethyl-N-propyloct-4-enimidamide
SMILES[H]/N=C(/CCC(C)=C(C)C(C)CC)N(C)CCC
InChIInChI=1S/C15H30N2/c1-7-11-17(6)15(16)10-9-13(4)14(5)12(3)8-2/h12,16H,7-11H2,1-6H3/b14-13?,16-15-
InChIKeyPTFCVXRWRUWATG-IVUOBRSISA-N
MW238.42 g/mol
LogP4.47
Rot. Bonds7

About N,4,5,6-tetramethyl-N-propyloct-4-enimidamide

N,4,5,6-tetramethyl-N-propyloct-4-enimidamide (PubChem CID 123534283) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is N,4,5,6-tetramethyl-N-propyloct-4-enimidamide.

Molecular Properties

Compound NameN,4,5,6-tetramethyl-N-propyloct-4-enimidamide
PubChem CID123534283
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC NameN,4,5,6-tetramethyl-N-propyloct-4-enimidamide
SMILES[H]/N=C(/CCC(C)=C(C)C(C)CC)N(C)CCC
InChIInChI=1S/C15H30N2/c1-7-11-17(6)15(16)10-9-13(4)14(5)12(3)8-2/h12,16H,7-11H2,1-6H3/b14-13?,16-15-
InChIKeyPTFCVXRWRUWATG-IVUOBRSISA-N
XLogP4.47
TPSA27.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 54.47
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'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

1-[(5Z)-5-methyl-3,4,7,8-tetrahydro-2H-azocin-1-yl]ethanimine
CID 142050922

Frequently Asked Questions

What is the IUPAC name of N,4,5,6-tetramethyl-N-propyloct-4-enimidamide?
The IUPAC name of N,4,5,6-tetramethyl-N-propyloct-4-enimidamide (CID 123534283) is N,4,5,6-tetramethyl-N-propyloct-4-enimidamide.
What is the SMILES notation for N,4,5,6-tetramethyl-N-propyloct-4-enimidamide?
The canonical SMILES for N,4,5,6-tetramethyl-N-propyloct-4-enimidamide is [H]/N=C(/CCC(C)=C(C)C(C)CC)N(C)CCC.
What is the InChIKey of N,4,5,6-tetramethyl-N-propyloct-4-enimidamide?
The InChIKey is PTFCVXRWRUWATG-IVUOBRSISA-N. The full InChI is InChI=1S/C15H30N2/c1-7-11-17(6)15(16)10-9-13(4)14(5)12(3)8-2/h12,16H,7-11H2,1-6H3/b14-13?,16-15-.
What are the key properties of N,4,5,6-tetramethyl-N-propyloct-4-enimidamide?
N,4,5,6-tetramethyl-N-propyloct-4-enimidamide has a molecular weight of 238.42 g/mol, XLogP of 4.47, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,4,5,6-tetramethyl-N-propyloct-4-enimidamide is sourced from PubChem (CID 123534283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).