N-diaminophosphoryl-N-methylpropan-2-amine

C4H14N3OP — CID 56612317

IUPACN-diaminophosphoryl-N-methylpropan-2-amine
SMILESCC(C)N(C)P(N)(N)=O
InChIInChI=1S/C4H14N3OP/c1-4(2)7(3)9(5,6)8/h4H,1-3H3,(H4,5,6,8)
InChIKeyRTLOXYPZAURDIX-UHFFFAOYSA-N
MW151.15 g/mol
LogP0.35
Rot. Bonds2

About N-diaminophosphoryl-N-methylpropan-2-amine

N-diaminophosphoryl-N-methylpropan-2-amine (PubChem CID 56612317) has the molecular formula C4H14N3OP and a molecular weight of 151.15 g/mol. Its IUPAC name is N-diaminophosphoryl-N-methylpropan-2-amine.

Molecular Properties

Compound NameN-diaminophosphoryl-N-methylpropan-2-amine
PubChem CID56612317
Molecular FormulaC4H14N3OP
Molecular Weight151.15 g/mol
Exact Mass151.09
IUPAC NameN-diaminophosphoryl-N-methylpropan-2-amine
SMILESCC(C)N(C)P(N)(N)=O
InChIInChI=1S/C4H14N3OP/c1-4(2)7(3)9(5,6)8/h4H,1-3H3,(H4,5,6,8)
InChIKeyRTLOXYPZAURDIX-UHFFFAOYSA-N
XLogP0.35
TPSA72.35 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.15
LogP ≤ 50.35
H-Bond Donors ≤ 52
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-diaminophosphoryl-N-methylpropan-2-amine?
The IUPAC name of N-diaminophosphoryl-N-methylpropan-2-amine (CID 56612317) is N-diaminophosphoryl-N-methylpropan-2-amine.
What is the SMILES notation for N-diaminophosphoryl-N-methylpropan-2-amine?
The canonical SMILES for N-diaminophosphoryl-N-methylpropan-2-amine is CC(C)N(C)P(N)(N)=O.
What is the InChIKey of N-diaminophosphoryl-N-methylpropan-2-amine?
The InChIKey is RTLOXYPZAURDIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H14N3OP/c1-4(2)7(3)9(5,6)8/h4H,1-3H3,(H4,5,6,8).
What are the key properties of N-diaminophosphoryl-N-methylpropan-2-amine?
N-diaminophosphoryl-N-methylpropan-2-amine has a molecular weight of 151.15 g/mol, XLogP of 0.35, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-diaminophosphoryl-N-methylpropan-2-amine is sourced from PubChem (CID 56612317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).