[amino(methyl)phosphoryl]methane;formonitrile

C3H9N2OP — CID 174424309

IUPAC[amino(methyl)phosphoryl]methane;formonitrile
SMILESC#N.CP(C)(N)=O
InChIInChI=1S/C2H8NOP.CHN/c1-5(2,3)4;1-2/h1-2H3,(H2,3,4);1H
InChIKeyITZKICQHABUKGF-UHFFFAOYSA-N
MW120.09 g/mol
LogP0.62
Rot. Bonds

About [amino(methyl)phosphoryl]methane;formonitrile

[amino(methyl)phosphoryl]methane;formonitrile (PubChem CID 174424309) has the molecular formula C3H9N2OP and a molecular weight of 120.09 g/mol. Its IUPAC name is [amino(methyl)phosphoryl]methane;formonitrile.

Molecular Properties

Compound Name[amino(methyl)phosphoryl]methane;formonitrile
PubChem CID174424309
Molecular FormulaC3H9N2OP
Molecular Weight120.09 g/mol
Exact Mass120.05
IUPAC Name[amino(methyl)phosphoryl]methane;formonitrile
SMILESC#N.CP(C)(N)=O
InChIInChI=1S/C2H8NOP.CHN/c1-5(2,3)4;1-2/h1-2H3,(H2,3,4);1H
InChIKeyITZKICQHABUKGF-UHFFFAOYSA-N
XLogP0.62
TPSA66.88 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500120.09
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

amino(methyl)phosphinate
CID 18377257
CID 159688873
CID 159688873
aminophosphonic acid;methylphosphonic acid
CID 87311898
[amino(methyl)phosphoryl]formamide
CID 163796895
aminophosphonic acid;dihydroxy-methyl-sulfanylidene-λ5-phosphane
CID 90199354
dimethylphosphorylmethane;hydron
CID 139251377
CID 159233079
CID 159233079
1-[amino(methyl)phosphinimyl]-1-[amino(methyl)phosphoryl]ethanamine
CID 163886314
CID 159146394
CID 159146394
bis(dimethylphosphoryl)methanamine
CID 23398083
methylphosphonic acid;trimethylphosphane;hydroiodide
CID 175283104
2-[amino(methyl)phosphoryl]-1H-azirine
CID 138529109

Frequently Asked Questions

What is the IUPAC name of [amino(methyl)phosphoryl]methane;formonitrile?
The IUPAC name of [amino(methyl)phosphoryl]methane;formonitrile (CID 174424309) is [amino(methyl)phosphoryl]methane;formonitrile.
What is the SMILES notation for [amino(methyl)phosphoryl]methane;formonitrile?
The canonical SMILES for [amino(methyl)phosphoryl]methane;formonitrile is C#N.CP(C)(N)=O.
What is the InChIKey of [amino(methyl)phosphoryl]methane;formonitrile?
The InChIKey is ITZKICQHABUKGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H8NOP.CHN/c1-5(2,3)4;1-2/h1-2H3,(H2,3,4);1H.
What are the key properties of [amino(methyl)phosphoryl]methane;formonitrile?
[amino(methyl)phosphoryl]methane;formonitrile has a molecular weight of 120.09 g/mol, XLogP of 0.62, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [amino(methyl)phosphoryl]methane;formonitrile is sourced from PubChem (CID 174424309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).