N-methylidene-N'-(2-methylprop-1-enyl)cyclopropanecarboximidamide

C9H14N2 — CID 138468396

IUPACN-methylidene-N'-(2-methylprop-1-enyl)cyclopropanecarboximidamide
SMILESC=N/C(=N\C=C(C)C)C1CC1
InChIInChI=1S/C9H14N2/c1-7(2)6-11-9(10-3)8-4-5-8/h6,8H,3-5H2,1-2H3/b11-9-
InChIKeyORSHCLCWAMLWGC-LUAWRHEFSA-N
MW150.22 g/mol
LogP2.42
Rot. Bonds2

About N-methylidene-N'-(2-methylprop-1-enyl)cyclopropanecarboximidamide

N-methylidene-N'-(2-methylprop-1-enyl)cyclopropanecarboximidamide (PubChem CID 138468396) has the molecular formula C9H14N2 and a molecular weight of 150.22 g/mol. Its IUPAC name is N-methylidene-N'-(2-methylprop-1-enyl)cyclopropanecarboximidamide.

Molecular Properties

Compound NameN-methylidene-N'-(2-methylprop-1-enyl)cyclopropanecarboximidamide
PubChem CID138468396
Molecular FormulaC9H14N2
Molecular Weight150.22 g/mol
Exact Mass150.12
IUPAC NameN-methylidene-N'-(2-methylprop-1-enyl)cyclopropanecarboximidamide
SMILESC=N/C(=N\C=C(C)C)C1CC1
InChIInChI=1S/C9H14N2/c1-7(2)6-11-9(10-3)8-4-5-8/h6,8H,3-5H2,1-2H3/b11-9-
InChIKeyORSHCLCWAMLWGC-LUAWRHEFSA-N
XLogP2.42
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 52.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'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-methylidene-N'-(2-methylprop-1-enyl)cyclopropanecarboximidamide?
The IUPAC name of N-methylidene-N'-(2-methylprop-1-enyl)cyclopropanecarboximidamide (CID 138468396) is N-methylidene-N'-(2-methylprop-1-enyl)cyclopropanecarboximidamide.
What is the SMILES notation for N-methylidene-N'-(2-methylprop-1-enyl)cyclopropanecarboximidamide?
The canonical SMILES for N-methylidene-N'-(2-methylprop-1-enyl)cyclopropanecarboximidamide is C=N/C(=N\C=C(C)C)C1CC1.
What is the InChIKey of N-methylidene-N'-(2-methylprop-1-enyl)cyclopropanecarboximidamide?
The InChIKey is ORSHCLCWAMLWGC-LUAWRHEFSA-N. The full InChI is InChI=1S/C9H14N2/c1-7(2)6-11-9(10-3)8-4-5-8/h6,8H,3-5H2,1-2H3/b11-9-.
What are the key properties of N-methylidene-N'-(2-methylprop-1-enyl)cyclopropanecarboximidamide?
N-methylidene-N'-(2-methylprop-1-enyl)cyclopropanecarboximidamide has a molecular weight of 150.22 g/mol, XLogP of 2.42, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methylidene-N'-(2-methylprop-1-enyl)cyclopropanecarboximidamide is sourced from PubChem (CID 138468396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).