N-[bis(dimethylamino)phosphinothioyl]-N-methylmethanamine

C6H18N3PS — CID 19510

IUPACN-[bis(dimethylamino)phosphinothioyl]-N-methylmethanamine
SMILESCN(C)P(=S)(N(C)C)N(C)C
InChIInChI=1S/C6H18N3PS/c1-7(2)10(11,8(3)4)9(5)6/h1-6H3
InChIKeyNPKXLCMBIGGTTQ-UHFFFAOYSA-N
MW195.27 g/mol
LogP0.90
Rot. Bonds3

About N-[bis(dimethylamino)phosphinothioyl]-N-methylmethanamine

N-[bis(dimethylamino)phosphinothioyl]-N-methylmethanamine (PubChem CID 19510) has the molecular formula C6H18N3PS and a molecular weight of 195.27 g/mol. Its IUPAC name is N-[bis(dimethylamino)phosphinothioyl]-N-methylmethanamine.

Molecular Properties

Compound NameN-[bis(dimethylamino)phosphinothioyl]-N-methylmethanamine
PubChem CID19510
Molecular FormulaC6H18N3PS
Molecular Weight195.27 g/mol
Exact Mass195.10
IUPAC NameN-[bis(dimethylamino)phosphinothioyl]-N-methylmethanamine
SMILESCN(C)P(=S)(N(C)C)N(C)C
InChIInChI=1S/C6H18N3PS/c1-7(2)10(11,8(3)4)9(5)6/h1-6H3
InChIKeyNPKXLCMBIGGTTQ-UHFFFAOYSA-N
XLogP0.90
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 50.90
H-Bond Donors ≤ 50
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-[bis(dimethylamino)phosphinothioyl]-N-methylmethanamine?
The IUPAC name of N-[bis(dimethylamino)phosphinothioyl]-N-methylmethanamine (CID 19510) is N-[bis(dimethylamino)phosphinothioyl]-N-methylmethanamine.
What is the SMILES notation for N-[bis(dimethylamino)phosphinothioyl]-N-methylmethanamine?
The canonical SMILES for N-[bis(dimethylamino)phosphinothioyl]-N-methylmethanamine is CN(C)P(=S)(N(C)C)N(C)C.
What is the InChIKey of N-[bis(dimethylamino)phosphinothioyl]-N-methylmethanamine?
The InChIKey is NPKXLCMBIGGTTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H18N3PS/c1-7(2)10(11,8(3)4)9(5)6/h1-6H3.
What are the key properties of N-[bis(dimethylamino)phosphinothioyl]-N-methylmethanamine?
N-[bis(dimethylamino)phosphinothioyl]-N-methylmethanamine has a molecular weight of 195.27 g/mol, XLogP of 0.90, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[bis(dimethylamino)phosphinothioyl]-N-methylmethanamine is sourced from PubChem (CID 19510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).