N'-(2-methylprop-1-enyl)methanimidamide

C5H10N2 — CID 123186436

IUPACN'-(2-methylprop-1-enyl)methanimidamide
SMILESCC(C)=C/N=C/N
InChIInChI=1S/C5H10N2/c1-5(2)3-7-4-6/h3-4H,1-2H3,(H2,6,7)
InChIKeyHVCLRXOBRSKHQS-UHFFFAOYSA-N
MW98.15 g/mol
LogP0.90
Rot. Bonds1

About N'-(2-methylprop-1-enyl)methanimidamide

N'-(2-methylprop-1-enyl)methanimidamide (PubChem CID 123186436) has the molecular formula C5H10N2 and a molecular weight of 98.15 g/mol. Its IUPAC name is N'-(2-methylprop-1-enyl)methanimidamide.

Molecular Properties

Compound NameN'-(2-methylprop-1-enyl)methanimidamide
PubChem CID123186436
Molecular FormulaC5H10N2
Molecular Weight98.15 g/mol
Exact Mass98.08
IUPAC NameN'-(2-methylprop-1-enyl)methanimidamide
SMILESCC(C)=C/N=C/N
InChIInChI=1S/C5H10N2/c1-5(2)3-7-4-6/h3-4H,1-2H3,(H2,6,7)
InChIKeyHVCLRXOBRSKHQS-UHFFFAOYSA-N
XLogP0.90
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50098.15
LogP ≤ 50.90
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'-(2-methylprop-1-enyl)methanimidamide with MolForge

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

Launch Full Analysis

Related Compounds

CID 22503876
CID 22503876
CID 123483423
CID 123483423
CID 138462458
CID 138462458
CID 24858
CID 24858
CID 57014191
CID 57014191
CID 88931617
CID 88931617
CID 88936329
CID 88936329
CID 89335540
CID 89335540
CID 89362422
CID 89362422
CID 89585196
CID 89585196
CID 89934043
CID 89934043
CID 90370992
CID 90370992

Frequently Asked Questions

What is the IUPAC name of N'-(2-methylprop-1-enyl)methanimidamide?
The IUPAC name of N'-(2-methylprop-1-enyl)methanimidamide (CID 123186436) is N'-(2-methylprop-1-enyl)methanimidamide.
What is the SMILES notation for N'-(2-methylprop-1-enyl)methanimidamide?
The canonical SMILES for N'-(2-methylprop-1-enyl)methanimidamide is CC(C)=C/N=C/N.
What is the InChIKey of N'-(2-methylprop-1-enyl)methanimidamide?
The InChIKey is HVCLRXOBRSKHQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2/c1-5(2)3-7-4-6/h3-4H,1-2H3,(H2,6,7).
What are the key properties of N'-(2-methylprop-1-enyl)methanimidamide?
N'-(2-methylprop-1-enyl)methanimidamide has a molecular weight of 98.15 g/mol, XLogP of 0.90, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-methylprop-1-enyl)methanimidamide is sourced from PubChem (CID 123186436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).