N'-[(Z)-oct-2-en-3-yl]ethanimidamide

C10H20N2 — CID 138509627

IUPACN'-[(Z)-oct-2-en-3-yl]ethanimidamide
SMILESC/C=C(CCCCC)\N=C(/C)N
InChIInChI=1S/C10H20N2/c1-4-6-7-8-10(5-2)12-9(3)11/h5H,4,6-8H2,1-3H3,(H2,11,12)/b10-5-
InChIKeyOQITVZSHCRONPN-YHYXMXQVSA-N
MW168.28 g/mol
LogP2.85
Rot. Bonds5

About N'-[(Z)-oct-2-en-3-yl]ethanimidamide

N'-[(Z)-oct-2-en-3-yl]ethanimidamide (PubChem CID 138509627) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is N'-[(Z)-oct-2-en-3-yl]ethanimidamide.

Molecular Properties

Compound NameN'-[(Z)-oct-2-en-3-yl]ethanimidamide
PubChem CID138509627
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC NameN'-[(Z)-oct-2-en-3-yl]ethanimidamide
SMILESC/C=C(CCCCC)\N=C(/C)N
InChIInChI=1S/C10H20N2/c1-4-6-7-8-10(5-2)12-9(3)11/h5H,4,6-8H2,1-3H3,(H2,11,12)/b10-5-
InChIKeyOQITVZSHCRONPN-YHYXMXQVSA-N
XLogP2.85
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

ethane;N'-hept-1-en-2-ylethanimidamide
CID 145472363
N-hept-2-en-3-ylethanimine
CID 23597524
3-methyldec-2-ene
CID 550799
(E)-3-methylnonadec-2-ene
CID 23160392
(E)-3-methyltridec-2-ene
CID 22000795
dec-2-en-3-amine
CID 154268798
(Z)-nonadec-2-en-3-amine
CID 139654417
(Z)-2-(ethylideneamino)hex-1-en-1-amine
CID 90227550
2-ethylideneoctadecanamide
CID 141119567
(E)-3-methyldodec-2-en-4-one
CID 102121544
3-methyloctadec-2-en-2-amine
CID 87741791
N,N'-bis(1-aminoethylidene)hexanediamide
CID 87475863

Frequently Asked Questions

What is the IUPAC name of N'-[(Z)-oct-2-en-3-yl]ethanimidamide?
The IUPAC name of N'-[(Z)-oct-2-en-3-yl]ethanimidamide (CID 138509627) is N'-[(Z)-oct-2-en-3-yl]ethanimidamide.
What is the SMILES notation for N'-[(Z)-oct-2-en-3-yl]ethanimidamide?
The canonical SMILES for N'-[(Z)-oct-2-en-3-yl]ethanimidamide is C/C=C(CCCCC)\N=C(/C)N.
What is the InChIKey of N'-[(Z)-oct-2-en-3-yl]ethanimidamide?
The InChIKey is OQITVZSHCRONPN-YHYXMXQVSA-N. The full InChI is InChI=1S/C10H20N2/c1-4-6-7-8-10(5-2)12-9(3)11/h5H,4,6-8H2,1-3H3,(H2,11,12)/b10-5-.
What are the key properties of N'-[(Z)-oct-2-en-3-yl]ethanimidamide?
N'-[(Z)-oct-2-en-3-yl]ethanimidamide has a molecular weight of 168.28 g/mol, XLogP of 2.85, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[(Z)-oct-2-en-3-yl]ethanimidamide is sourced from PubChem (CID 138509627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).