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

C6H17N2PS — CID 23280360

IUPACN-[dimethylamino(ethyl)phosphinothioyl]-N-methylmethanamine
SMILESCCP(=S)(N(C)C)N(C)C
InChIInChI=1S/C6H17N2PS/c1-6-9(10,7(2)3)8(4)5/h6H2,1-5H3
InChIKeyPSCFLVYHUMMUHV-UHFFFAOYSA-N
MW180.26 g/mol
LogP1.44
Rot. Bonds3

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

N-[dimethylamino(ethyl)phosphinothioyl]-N-methylmethanamine (PubChem CID 23280360) has the molecular formula C6H17N2PS and a molecular weight of 180.26 g/mol. Its IUPAC name is N-[dimethylamino(ethyl)phosphinothioyl]-N-methylmethanamine.

Molecular Properties

Compound NameN-[dimethylamino(ethyl)phosphinothioyl]-N-methylmethanamine
PubChem CID23280360
Molecular FormulaC6H17N2PS
Molecular Weight180.26 g/mol
Exact Mass180.09
IUPAC NameN-[dimethylamino(ethyl)phosphinothioyl]-N-methylmethanamine
SMILESCCP(=S)(N(C)C)N(C)C
InChIInChI=1S/C6H17N2PS/c1-6-9(10,7(2)3)8(4)5/h6H2,1-5H3
InChIKeyPSCFLVYHUMMUHV-UHFFFAOYSA-N
XLogP1.44
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.26
LogP ≤ 51.44
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-[dimethylamino(ethyl)phosphinothioyl]-N-methylmethanamine?
The IUPAC name of N-[dimethylamino(ethyl)phosphinothioyl]-N-methylmethanamine (CID 23280360) is N-[dimethylamino(ethyl)phosphinothioyl]-N-methylmethanamine.
What is the SMILES notation for N-[dimethylamino(ethyl)phosphinothioyl]-N-methylmethanamine?
The canonical SMILES for N-[dimethylamino(ethyl)phosphinothioyl]-N-methylmethanamine is CCP(=S)(N(C)C)N(C)C.
What is the InChIKey of N-[dimethylamino(ethyl)phosphinothioyl]-N-methylmethanamine?
The InChIKey is PSCFLVYHUMMUHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H17N2PS/c1-6-9(10,7(2)3)8(4)5/h6H2,1-5H3.
What are the key properties of N-[dimethylamino(ethyl)phosphinothioyl]-N-methylmethanamine?
N-[dimethylamino(ethyl)phosphinothioyl]-N-methylmethanamine has a molecular weight of 180.26 g/mol, XLogP of 1.44, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[dimethylamino(ethyl)phosphinothioyl]-N-methylmethanamine is sourced from PubChem (CID 23280360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).