2-methyl-2-N,2-N,4-N,4-N-tetraphenyl-4-phosphanylpentane-2,4-diamine

C30H33N2P — CID 143197481

IUPAC2-methyl-2-N,2-N,4-N,4-N-tetraphenyl-4-phosphanylpentane-2,4-diamine
SMILESCC(C)(CC(C)(P)N(c1ccccc1)c1ccccc1)N(c1ccccc1)c1ccccc1
InChIInChI=1S/C30H33N2P/c1-29(2,31(25-16-8-4-9-17-25)26-18-10-5-11-19-26)24-30(3,33)32(27-20-12-6-13-21-27)28-22-14-7-15-23-28/h4-23H,24,33H2,1-3H3
InChIKeyNUTNREXHSMLKQC-UHFFFAOYSA-N
MW452.58 g/mol
LogP8.42
Rot. Bonds8

About 2-methyl-2-N,2-N,4-N,4-N-tetraphenyl-4-phosphanylpentane-2,4-diamine

2-methyl-2-N,2-N,4-N,4-N-tetraphenyl-4-phosphanylpentane-2,4-diamine (PubChem CID 143197481) has the molecular formula C30H33N2P and a molecular weight of 452.58 g/mol. Its IUPAC name is 2-methyl-2-N,2-N,4-N,4-N-tetraphenyl-4-phosphanylpentane-2,4-diamine.

Molecular Properties

Compound Name2-methyl-2-N,2-N,4-N,4-N-tetraphenyl-4-phosphanylpentane-2,4-diamine
PubChem CID143197481
Molecular FormulaC30H33N2P
Molecular Weight452.58 g/mol
Exact Mass452.24
IUPAC Name2-methyl-2-N,2-N,4-N,4-N-tetraphenyl-4-phosphanylpentane-2,4-diamine
SMILESCC(C)(CC(C)(P)N(c1ccccc1)c1ccccc1)N(c1ccccc1)c1ccccc1
InChIInChI=1S/C30H33N2P/c1-29(2,31(25-16-8-4-9-17-25)26-18-10-5-11-19-26)24-30(3,33)32(27-20-12-6-13-21-27)28-22-14-7-15-23-28/h4-23H,24,33H2,1-3H3
InChIKeyNUTNREXHSMLKQC-UHFFFAOYSA-N
XLogP8.42
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500452.58
LogP ≤ 58.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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-methyl-2-N,2-N,4-N,4-N-tetraphenyl-4-phosphanylpentane-2,4-diamine?
The IUPAC name of 2-methyl-2-N,2-N,4-N,4-N-tetraphenyl-4-phosphanylpentane-2,4-diamine (CID 143197481) is 2-methyl-2-N,2-N,4-N,4-N-tetraphenyl-4-phosphanylpentane-2,4-diamine.
What is the SMILES notation for 2-methyl-2-N,2-N,4-N,4-N-tetraphenyl-4-phosphanylpentane-2,4-diamine?
The canonical SMILES for 2-methyl-2-N,2-N,4-N,4-N-tetraphenyl-4-phosphanylpentane-2,4-diamine is CC(C)(CC(C)(P)N(c1ccccc1)c1ccccc1)N(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-methyl-2-N,2-N,4-N,4-N-tetraphenyl-4-phosphanylpentane-2,4-diamine?
The InChIKey is NUTNREXHSMLKQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H33N2P/c1-29(2,31(25-16-8-4-9-17-25)26-18-10-5-11-19-26)24-30(3,33)32(27-20-12-6-13-21-27)28-22-14-7-15-23-28/h4-23H,24,33H2,1-3H3.
What are the key properties of 2-methyl-2-N,2-N,4-N,4-N-tetraphenyl-4-phosphanylpentane-2,4-diamine?
2-methyl-2-N,2-N,4-N,4-N-tetraphenyl-4-phosphanylpentane-2,4-diamine has a molecular weight of 452.58 g/mol, XLogP of 8.42, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-N,2-N,4-N,4-N-tetraphenyl-4-phosphanylpentane-2,4-diamine is sourced from PubChem (CID 143197481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).