(2-methylaziridin-1-yl)phosphinous acid

C3H8NOP — CID 118349133

IUPAC(2-methylaziridin-1-yl)phosphinous acid
SMILESCC1CN1PO
InChIInChI=1S/C3H8NOP/c1-3-2-4(3)6-5/h3,5-6H,2H2,1H3
InChIKeyHAPWBBAMKUDROO-UHFFFAOYSA-N
MW105.08 g/mol
LogP0.19
Rot. Bonds1

About (2-methylaziridin-1-yl)phosphinous acid

(2-methylaziridin-1-yl)phosphinous acid (PubChem CID 118349133) has the molecular formula C3H8NOP and a molecular weight of 105.08 g/mol. Its IUPAC name is (2-methylaziridin-1-yl)phosphinous acid.

Molecular Properties

Compound Name(2-methylaziridin-1-yl)phosphinous acid
PubChem CID118349133
Molecular FormulaC3H8NOP
Molecular Weight105.08 g/mol
Exact Mass105.03
IUPAC Name(2-methylaziridin-1-yl)phosphinous acid
SMILESCC1CN1PO
InChIInChI=1S/C3H8NOP/c1-3-2-4(3)6-5/h3,5-6H,2H2,1H3
InChIKeyHAPWBBAMKUDROO-UHFFFAOYSA-N
XLogP0.19
TPSA23.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500105.08
LogP ≤ 50.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2-methylaziridin-1-yl)phosphinous acid?
The IUPAC name of (2-methylaziridin-1-yl)phosphinous acid (CID 118349133) is (2-methylaziridin-1-yl)phosphinous acid.
What is the SMILES notation for (2-methylaziridin-1-yl)phosphinous acid?
The canonical SMILES for (2-methylaziridin-1-yl)phosphinous acid is CC1CN1PO.
What is the InChIKey of (2-methylaziridin-1-yl)phosphinous acid?
The InChIKey is HAPWBBAMKUDROO-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8NOP/c1-3-2-4(3)6-5/h3,5-6H,2H2,1H3.
What are the key properties of (2-methylaziridin-1-yl)phosphinous acid?
(2-methylaziridin-1-yl)phosphinous acid has a molecular weight of 105.08 g/mol, XLogP of 0.19, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylaziridin-1-yl)phosphinous acid is sourced from PubChem (CID 118349133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).