N-[iodo(triphenyl)-λ5-phosphanyl]-N,2-dimethylpropan-2-amine

C23H27INP — CID 134884379

IUPACN-[iodo(triphenyl)-λ5-phosphanyl]-N,2-dimethylpropan-2-amine
SMILESCN(C(C)(C)C)P(I)(c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C23H27INP/c1-23(2,3)25(4)26(24,20-14-8-5-9-15-20,21-16-10-6-11-17-21)22-18-12-7-13-19-22/h5-19H,1-4H3
InChIKeyOESWUPIOYGZCSU-UHFFFAOYSA-N
MW475.35 g/mol
LogP5.51
Rot. Bonds4

About N-[iodo(triphenyl)-λ5-phosphanyl]-N,2-dimethylpropan-2-amine

N-[iodo(triphenyl)-λ5-phosphanyl]-N,2-dimethylpropan-2-amine (PubChem CID 134884379) has the molecular formula C23H27INP and a molecular weight of 475.35 g/mol. Its IUPAC name is N-[iodo(triphenyl)-λ5-phosphanyl]-N,2-dimethylpropan-2-amine.

Molecular Properties

Compound NameN-[iodo(triphenyl)-λ5-phosphanyl]-N,2-dimethylpropan-2-amine
PubChem CID134884379
Molecular FormulaC23H27INP
Molecular Weight475.35 g/mol
Exact Mass475.09
IUPAC NameN-[iodo(triphenyl)-λ5-phosphanyl]-N,2-dimethylpropan-2-amine
SMILESCN(C(C)(C)C)P(I)(c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C23H27INP/c1-23(2,3)25(4)26(24,20-14-8-5-9-15-20,21-16-10-6-11-17-21)22-18-12-7-13-19-22/h5-19H,1-4H3
InChIKeyOESWUPIOYGZCSU-UHFFFAOYSA-N
XLogP5.51
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500475.35
LogP ≤ 55.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N-[iodo(triphenyl)-λ5-phosphanyl]-N,2-dimethylpropan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[iodo-tris(N-methylanilino)-lambda5-phosphanyl]-N-methylaniline
CID 2784141
N-ethyl-N-[iodo(triphenyl)-lambda5-phosphanyl]cyclohexanamine
CID 13480762
iodo-(1-iodoethyl)-triphenyl-λ5-phosphane
CID 134886738
N,N,N',N'-tetratert-butyl-1-phenylmethanediamine
CID 132599756
tert-butylbenzene;N,N-dimethylmethanamine;ethane
CID 158234617
methyl 2-[iodo(triphenyl)-λ5-phosphanyl]-2-methylpropanedithioate
CID 134976900
CID 71339905
CID 71339905
(1R,3R)-2,2-dimethyl-1,3-diphenylpropane-1,3-diol
CID 100943216
carbanide;gold;gold(3+);bis(iodo-dimethanidyl-diphenyl-λ5-phosphane)
CID 135046201
propylbenzene;N,N,2-trimethylpropan-2-amine
CID 91496276
N,N-diethyl-1-[iodo(triphenyl)-lambda5-phosphanyl]propan-2-amine
CID 14323061
2-[bromo(triphenyl)-λ5-phosphanyl]-2-methyl-1-phenylpropan-1-ol
CID 134976890

Frequently Asked Questions

What is the IUPAC name of N-[iodo(triphenyl)-λ5-phosphanyl]-N,2-dimethylpropan-2-amine?
The IUPAC name of N-[iodo(triphenyl)-λ5-phosphanyl]-N,2-dimethylpropan-2-amine (CID 134884379) is N-[iodo(triphenyl)-λ5-phosphanyl]-N,2-dimethylpropan-2-amine.
What is the SMILES notation for N-[iodo(triphenyl)-λ5-phosphanyl]-N,2-dimethylpropan-2-amine?
The canonical SMILES for N-[iodo(triphenyl)-λ5-phosphanyl]-N,2-dimethylpropan-2-amine is CN(C(C)(C)C)P(I)(c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of N-[iodo(triphenyl)-λ5-phosphanyl]-N,2-dimethylpropan-2-amine?
The InChIKey is OESWUPIOYGZCSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27INP/c1-23(2,3)25(4)26(24,20-14-8-5-9-15-20,21-16-10-6-11-17-21)22-18-12-7-13-19-22/h5-19H,1-4H3.
What are the key properties of N-[iodo(triphenyl)-λ5-phosphanyl]-N,2-dimethylpropan-2-amine?
N-[iodo(triphenyl)-λ5-phosphanyl]-N,2-dimethylpropan-2-amine has a molecular weight of 475.35 g/mol, XLogP of 5.51, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[iodo(triphenyl)-λ5-phosphanyl]-N,2-dimethylpropan-2-amine is sourced from PubChem (CID 134884379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).