2-[2,6-bis(dimethylamino)phenyl]phosphanyl-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine

C20H31N4P — CID 18705990

IUPAC2-[2,6-bis(dimethylamino)phenyl]phosphanyl-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine
SMILESCN(C)c1cccc(N(C)C)c1Pc1c(N(C)C)cccc1N(C)C
InChIInChI=1S/C20H31N4P/c1-21(2)15-11-9-12-16(22(3)4)19(15)25-20-17(23(5)6)13-10-14-18(20)24(7)8/h9-14,25H,1-8H3
InChIKeyFDMGTQUZSMPDJR-UHFFFAOYSA-N
MW358.47 g/mol
LogP2.58
Rot. Bonds6

About 2-[2,6-bis(dimethylamino)phenyl]phosphanyl-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine

2-[2,6-bis(dimethylamino)phenyl]phosphanyl-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine (PubChem CID 18705990) has the molecular formula C20H31N4P and a molecular weight of 358.47 g/mol. Its IUPAC name is 2-[2,6-bis(dimethylamino)phenyl]phosphanyl-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine.

Molecular Properties

Compound Name2-[2,6-bis(dimethylamino)phenyl]phosphanyl-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine
PubChem CID18705990
Molecular FormulaC20H31N4P
Molecular Weight358.47 g/mol
Exact Mass358.23
IUPAC Name2-[2,6-bis(dimethylamino)phenyl]phosphanyl-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine
SMILESCN(C)c1cccc(N(C)C)c1Pc1c(N(C)C)cccc1N(C)C
InChIInChI=1S/C20H31N4P/c1-21(2)15-11-9-12-16(22(3)4)19(15)25-20-17(23(5)6)13-10-14-18(20)24(7)8/h9-14,25H,1-8H3
InChIKeyFDMGTQUZSMPDJR-UHFFFAOYSA-N
XLogP2.58
TPSA12.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.47
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[2,6-bis(dimethylamino)phenyl]phosphanyl-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine?
The IUPAC name of 2-[2,6-bis(dimethylamino)phenyl]phosphanyl-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine (CID 18705990) is 2-[2,6-bis(dimethylamino)phenyl]phosphanyl-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine.
What is the SMILES notation for 2-[2,6-bis(dimethylamino)phenyl]phosphanyl-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine?
The canonical SMILES for 2-[2,6-bis(dimethylamino)phenyl]phosphanyl-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine is CN(C)c1cccc(N(C)C)c1Pc1c(N(C)C)cccc1N(C)C.
What is the InChIKey of 2-[2,6-bis(dimethylamino)phenyl]phosphanyl-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine?
The InChIKey is FDMGTQUZSMPDJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H31N4P/c1-21(2)15-11-9-12-16(22(3)4)19(15)25-20-17(23(5)6)13-10-14-18(20)24(7)8/h9-14,25H,1-8H3.
What are the key properties of 2-[2,6-bis(dimethylamino)phenyl]phosphanyl-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine?
2-[2,6-bis(dimethylamino)phenyl]phosphanyl-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine has a molecular weight of 358.47 g/mol, XLogP of 2.58, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2,6-bis(dimethylamino)phenyl]phosphanyl-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine is sourced from PubChem (CID 18705990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).