N-diaminophosphorylmethanamine

CH8N3OP — CID 21266285

IUPACN-diaminophosphorylmethanamine
SMILESCNP(N)(N)=O
InChIInChI=1S/CH8N3OP/c1-4-6(2,3)5/h1H3,(H5,2,3,4,5)
InChIKeyDISPOJHKKXSCLS-UHFFFAOYSA-N
MW109.07 g/mol
LogP-0.77
Rot. Bonds1

About N-diaminophosphorylmethanamine

N-diaminophosphorylmethanamine (PubChem CID 21266285) has the molecular formula CH8N3OP and a molecular weight of 109.07 g/mol. Its IUPAC name is N-diaminophosphorylmethanamine.

Molecular Properties

Compound NameN-diaminophosphorylmethanamine
PubChem CID21266285
Molecular FormulaCH8N3OP
Molecular Weight109.07 g/mol
Exact Mass109.04
IUPAC NameN-diaminophosphorylmethanamine
SMILESCNP(N)(N)=O
InChIInChI=1S/CH8N3OP/c1-4-6(2,3)5/h1H3,(H5,2,3,4,5)
InChIKeyDISPOJHKKXSCLS-UHFFFAOYSA-N
XLogP-0.77
TPSA81.14 Ų
H-Bond Donors3
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500109.07
LogP ≤ 5-0.77
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-diaminophosphorylmethanamine?
The IUPAC name of N-diaminophosphorylmethanamine (CID 21266285) is N-diaminophosphorylmethanamine.
What is the SMILES notation for N-diaminophosphorylmethanamine?
The canonical SMILES for N-diaminophosphorylmethanamine is CNP(N)(N)=O.
What is the InChIKey of N-diaminophosphorylmethanamine?
The InChIKey is DISPOJHKKXSCLS-UHFFFAOYSA-N. The full InChI is InChI=1S/CH8N3OP/c1-4-6(2,3)5/h1H3,(H5,2,3,4,5).
What are the key properties of N-diaminophosphorylmethanamine?
N-diaminophosphorylmethanamine has a molecular weight of 109.07 g/mol, XLogP of -0.77, 1 rotatable bonds, 3 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-diaminophosphorylmethanamine is sourced from PubChem (CID 21266285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).