N,N,N',N',N",N"-hexamethyl-1-phosphanylmethanetriamine

C7H20N3P — CID 19807646

IUPACN,N,N',N',N",N"-hexamethyl-1-phosphanylmethanetriamine
SMILESCN(C)C(P)(N(C)C)N(C)C
InChIInChI=1S/C7H20N3P/c1-8(2)7(11,9(3)4)10(5)6/h11H2,1-6H3
InChIKeyMLAGFLHFBZWNKA-UHFFFAOYSA-N
MW177.23 g/mol
LogP0.16
Rot. Bonds3

About N,N,N',N',N",N"-hexamethyl-1-phosphanylmethanetriamine

N,N,N',N',N",N"-hexamethyl-1-phosphanylmethanetriamine (PubChem CID 19807646) has the molecular formula C7H20N3P and a molecular weight of 177.23 g/mol. Its IUPAC name is N,N,N',N',N",N"-hexamethyl-1-phosphanylmethanetriamine.

Molecular Properties

Compound NameN,N,N',N',N",N"-hexamethyl-1-phosphanylmethanetriamine
PubChem CID19807646
Molecular FormulaC7H20N3P
Molecular Weight177.23 g/mol
Exact Mass177.14
IUPAC NameN,N,N',N',N",N"-hexamethyl-1-phosphanylmethanetriamine
SMILESCN(C)C(P)(N(C)C)N(C)C
InChIInChI=1S/C7H20N3P/c1-8(2)7(11,9(3)4)10(5)6/h11H2,1-6H3
InChIKeyMLAGFLHFBZWNKA-UHFFFAOYSA-N
XLogP0.16
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.23
LogP ≤ 50.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N,N,N',N',N",N"-hexamethyl-1-phosphanylmethanetriamine?
The IUPAC name of N,N,N',N',N",N"-hexamethyl-1-phosphanylmethanetriamine (CID 19807646) is N,N,N',N',N",N"-hexamethyl-1-phosphanylmethanetriamine.
What is the SMILES notation for N,N,N',N',N",N"-hexamethyl-1-phosphanylmethanetriamine?
The canonical SMILES for N,N,N',N',N",N"-hexamethyl-1-phosphanylmethanetriamine is CN(C)C(P)(N(C)C)N(C)C.
What is the InChIKey of N,N,N',N',N",N"-hexamethyl-1-phosphanylmethanetriamine?
The InChIKey is MLAGFLHFBZWNKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H20N3P/c1-8(2)7(11,9(3)4)10(5)6/h11H2,1-6H3.
What are the key properties of N,N,N',N',N",N"-hexamethyl-1-phosphanylmethanetriamine?
N,N,N',N',N",N"-hexamethyl-1-phosphanylmethanetriamine has a molecular weight of 177.23 g/mol, XLogP of 0.16, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,N',N',N",N"-hexamethyl-1-phosphanylmethanetriamine is sourced from PubChem (CID 19807646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).