N-methyl-N'-(phosphanylmethyl)methanediimine

C3H7N2P — CID 58732083

IUPACN-methyl-N'-(phosphanylmethyl)methanediimine
SMILESCN=C=NCP
InChIInChI=1S/C3H7N2P/c1-4-2-5-3-6/h3,6H2,1H3
InChIKeyRAMZAQSKVJZZQR-UHFFFAOYSA-N
MW102.08 g/mol
LogP0.62
Rot. Bonds1

About N-methyl-N'-(phosphanylmethyl)methanediimine

N-methyl-N'-(phosphanylmethyl)methanediimine (PubChem CID 58732083) has the molecular formula C3H7N2P and a molecular weight of 102.08 g/mol. Its IUPAC name is N-methyl-N'-(phosphanylmethyl)methanediimine.

Molecular Properties

Compound NameN-methyl-N'-(phosphanylmethyl)methanediimine
PubChem CID58732083
Molecular FormulaC3H7N2P
Molecular Weight102.08 g/mol
Exact Mass102.03
IUPAC NameN-methyl-N'-(phosphanylmethyl)methanediimine
SMILESCN=C=NCP
InChIInChI=1S/C3H7N2P/c1-4-2-5-3-6/h3,6H2,1H3
InChIKeyRAMZAQSKVJZZQR-UHFFFAOYSA-N
XLogP0.62
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms6
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500102.08
LogP ≤ 50.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N'-(phosphanylmethyl)methanediimine?
The IUPAC name of N-methyl-N'-(phosphanylmethyl)methanediimine (CID 58732083) is N-methyl-N'-(phosphanylmethyl)methanediimine.
What is the SMILES notation for N-methyl-N'-(phosphanylmethyl)methanediimine?
The canonical SMILES for N-methyl-N'-(phosphanylmethyl)methanediimine is CN=C=NCP.
What is the InChIKey of N-methyl-N'-(phosphanylmethyl)methanediimine?
The InChIKey is RAMZAQSKVJZZQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7N2P/c1-4-2-5-3-6/h3,6H2,1H3.
What are the key properties of N-methyl-N'-(phosphanylmethyl)methanediimine?
N-methyl-N'-(phosphanylmethyl)methanediimine has a molecular weight of 102.08 g/mol, XLogP of 0.62, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N'-(phosphanylmethyl)methanediimine is sourced from PubChem (CID 58732083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).