N'-hex-1-enyl-N-methylidenemethanimidamide

C8H14N2 — CID 91570031

IUPACN'-hex-1-enyl-N-methylidenemethanimidamide
SMILESC=N/C=N/C=CCCCC
InChIInChI=1S/C8H14N2/c1-3-4-5-6-7-10-8-9-2/h6-8H,2-5H2,1H3/b7-6?,10-8+
InChIKeyYPHSJCPMPJHEFY-NACQSJNXSA-N
MW138.21 g/mol
LogP2.42
Rot. Bonds5

About N'-hex-1-enyl-N-methylidenemethanimidamide

N'-hex-1-enyl-N-methylidenemethanimidamide (PubChem CID 91570031) has the molecular formula C8H14N2 and a molecular weight of 138.21 g/mol. Its IUPAC name is N'-hex-1-enyl-N-methylidenemethanimidamide.

Molecular Properties

Compound NameN'-hex-1-enyl-N-methylidenemethanimidamide
PubChem CID91570031
Molecular FormulaC8H14N2
Molecular Weight138.21 g/mol
Exact Mass138.12
IUPAC NameN'-hex-1-enyl-N-methylidenemethanimidamide
SMILESC=N/C=N/C=CCCCC
InChIInChI=1S/C8H14N2/c1-3-4-5-6-7-10-8-9-2/h6-8H,2-5H2,1H3/b7-6?,10-8+
InChIKeyYPHSJCPMPJHEFY-NACQSJNXSA-N
XLogP2.42
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 52.42
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'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N'-hex-1-enyl-N-methylidenemethanimidamide?
The IUPAC name of N'-hex-1-enyl-N-methylidenemethanimidamide (CID 91570031) is N'-hex-1-enyl-N-methylidenemethanimidamide.
What is the SMILES notation for N'-hex-1-enyl-N-methylidenemethanimidamide?
The canonical SMILES for N'-hex-1-enyl-N-methylidenemethanimidamide is C=N/C=N/C=CCCCC.
What is the InChIKey of N'-hex-1-enyl-N-methylidenemethanimidamide?
The InChIKey is YPHSJCPMPJHEFY-NACQSJNXSA-N. The full InChI is InChI=1S/C8H14N2/c1-3-4-5-6-7-10-8-9-2/h6-8H,2-5H2,1H3/b7-6?,10-8+.
What are the key properties of N'-hex-1-enyl-N-methylidenemethanimidamide?
N'-hex-1-enyl-N-methylidenemethanimidamide has a molecular weight of 138.21 g/mol, XLogP of 2.42, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-hex-1-enyl-N-methylidenemethanimidamide is sourced from PubChem (CID 91570031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).