N-hex-1-en-2-yl-N-methylmethanimidamide

C8H16N2 — CID 144993488

IUPACN-hex-1-en-2-yl-N-methylmethanimidamide
SMILES[H]/N=C/N(C)C(=C)CCCC
InChIInChI=1S/C8H16N2/c1-4-5-6-8(2)10(3)7-9/h7,9H,2,4-6H2,1,3H3/b9-7+
InChIKeyDSZVYFWREWHVGV-VQHVLOKHSA-N
MW140.23 g/mol
LogP2.23
Rot. Bonds5

About N-hex-1-en-2-yl-N-methylmethanimidamide

N-hex-1-en-2-yl-N-methylmethanimidamide (PubChem CID 144993488) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is N-hex-1-en-2-yl-N-methylmethanimidamide.

Molecular Properties

Compound NameN-hex-1-en-2-yl-N-methylmethanimidamide
PubChem CID144993488
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC NameN-hex-1-en-2-yl-N-methylmethanimidamide
SMILES[H]/N=C/N(C)C(=C)CCCC
InChIInChI=1S/C8H16N2/c1-4-5-6-8(2)10(3)7-9/h7,9H,2,4-6H2,1,3H3/b9-7+
InChIKeyDSZVYFWREWHVGV-VQHVLOKHSA-N
XLogP2.23
TPSA27.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 52.23
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'}

Analyze N-hex-1-en-2-yl-N-methylmethanimidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-hex-1-en-2-yl-N-methylmethanimidamide?
The IUPAC name of N-hex-1-en-2-yl-N-methylmethanimidamide (CID 144993488) is N-hex-1-en-2-yl-N-methylmethanimidamide.
What is the SMILES notation for N-hex-1-en-2-yl-N-methylmethanimidamide?
The canonical SMILES for N-hex-1-en-2-yl-N-methylmethanimidamide is [H]/N=C/N(C)C(=C)CCCC.
What is the InChIKey of N-hex-1-en-2-yl-N-methylmethanimidamide?
The InChIKey is DSZVYFWREWHVGV-VQHVLOKHSA-N. The full InChI is InChI=1S/C8H16N2/c1-4-5-6-8(2)10(3)7-9/h7,9H,2,4-6H2,1,3H3/b9-7+.
What are the key properties of N-hex-1-en-2-yl-N-methylmethanimidamide?
N-hex-1-en-2-yl-N-methylmethanimidamide has a molecular weight of 140.23 g/mol, XLogP of 2.23, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-hex-1-en-2-yl-N-methylmethanimidamide is sourced from PubChem (CID 144993488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).