N-[bis(dimethylamino)phosphinothioylimino-bis(dimethylamino)-lambda5-phosphanyl]-N-methylmethanamine

C10H30N6P2S — CID 12652574

IUPACN-[bis(dimethylamino)phosphinothioylimino-bis(dimethylamino)-lambda5-phosphanyl]-N-methylmethanamine
SMILESCN(C)P(=NP(=S)(N(C)C)N(C)C)(N(C)C)N(C)C
InChIInChI=1S/C10H30N6P2S/c1-12(2)17(13(3)4,14(5)6)11-18(19,15(7)8)16(9)10/h1-10H3
InChIKeyOCARMEXPQVKJRF-UHFFFAOYSA-N
MW328.40 g/mol
LogP2.50
Rot. Bonds6

About N-[bis(dimethylamino)phosphinothioylimino-bis(dimethylamino)-lambda5-phosphanyl]-N-methylmethanamine

N-[bis(dimethylamino)phosphinothioylimino-bis(dimethylamino)-lambda5-phosphanyl]-N-methylmethanamine (PubChem CID 12652574) has the molecular formula C10H30N6P2S and a molecular weight of 328.40 g/mol. Its IUPAC name is N-[bis(dimethylamino)phosphinothioylimino-bis(dimethylamino)-lambda5-phosphanyl]-N-methylmethanamine.

Molecular Properties

Compound NameN-[bis(dimethylamino)phosphinothioylimino-bis(dimethylamino)-lambda5-phosphanyl]-N-methylmethanamine
PubChem CID12652574
Molecular FormulaC10H30N6P2S
Molecular Weight328.40 g/mol
Exact Mass328.17
IUPAC NameN-[bis(dimethylamino)phosphinothioylimino-bis(dimethylamino)-lambda5-phosphanyl]-N-methylmethanamine
SMILESCN(C)P(=NP(=S)(N(C)C)N(C)C)(N(C)C)N(C)C
InChIInChI=1S/C10H30N6P2S/c1-12(2)17(13(3)4,14(5)6)11-18(19,15(7)8)16(9)10/h1-10H3
InChIKeyOCARMEXPQVKJRF-UHFFFAOYSA-N
XLogP2.50
TPSA60.70 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms19
Complexity351

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.40
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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)phosphinothioylimino-bis(dimethylamino)-lambda5-phosphanyl]-N-methylmethanamine?
The IUPAC name of N-[bis(dimethylamino)phosphinothioylimino-bis(dimethylamino)-lambda5-phosphanyl]-N-methylmethanamine (CID 12652574) is N-[bis(dimethylamino)phosphinothioylimino-bis(dimethylamino)-lambda5-phosphanyl]-N-methylmethanamine.
What is the SMILES notation for N-[bis(dimethylamino)phosphinothioylimino-bis(dimethylamino)-lambda5-phosphanyl]-N-methylmethanamine?
The canonical SMILES for N-[bis(dimethylamino)phosphinothioylimino-bis(dimethylamino)-lambda5-phosphanyl]-N-methylmethanamine is CN(C)P(=NP(=S)(N(C)C)N(C)C)(N(C)C)N(C)C.
What is the InChIKey of N-[bis(dimethylamino)phosphinothioylimino-bis(dimethylamino)-lambda5-phosphanyl]-N-methylmethanamine?
The InChIKey is OCARMEXPQVKJRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H30N6P2S/c1-12(2)17(13(3)4,14(5)6)11-18(19,15(7)8)16(9)10/h1-10H3.
What are the key properties of N-[bis(dimethylamino)phosphinothioylimino-bis(dimethylamino)-lambda5-phosphanyl]-N-methylmethanamine?
N-[bis(dimethylamino)phosphinothioylimino-bis(dimethylamino)-lambda5-phosphanyl]-N-methylmethanamine has a molecular weight of 328.40 g/mol, XLogP of 2.50, 6 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[bis(dimethylamino)phosphinothioylimino-bis(dimethylamino)-lambda5-phosphanyl]-N-methylmethanamine is sourced from PubChem (CID 12652574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).