N-[6-[(2-methoxyphenyl)-phenylphosphanyl]-2-pyridinyl]-2,2-dimethylpropanamide

C23H25N2O2P — CID 102181078

IUPACN-[6-[(2-methoxyphenyl)-phenylphosphanyl]-2-pyridinyl]-2,2-dimethylpropanamide
SMILESCOc1ccccc1P(c1ccccc1)c1cccc(NC(=O)C(C)(C)C)n1
InChIInChI=1S/C23H25N2O2P/c1-23(2,3)22(26)25-20-15-10-16-21(24-20)28(17-11-6-5-7-12-17)19-14-9-8-13-18(19)27-4/h5-16H,1-4H3,(H,24,25,26)
InChIKeyQZSLJYODDDUCPW-UHFFFAOYSA-N
MW392.44 g/mol
LogP3.83
Rot. Bonds5

About N-[6-[(2-methoxyphenyl)-phenylphosphanyl]-2-pyridinyl]-2,2-dimethylpropanamide

N-[6-[(2-methoxyphenyl)-phenylphosphanyl]-2-pyridinyl]-2,2-dimethylpropanamide (PubChem CID 102181078) has the molecular formula C23H25N2O2P and a molecular weight of 392.44 g/mol. Its IUPAC name is N-[6-[(2-methoxyphenyl)-phenylphosphanyl]-2-pyridinyl]-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-[6-[(2-methoxyphenyl)-phenylphosphanyl]-2-pyridinyl]-2,2-dimethylpropanamide
PubChem CID102181078
Molecular FormulaC23H25N2O2P
Molecular Weight392.44 g/mol
Exact Mass392.17
IUPAC NameN-[6-[(2-methoxyphenyl)-phenylphosphanyl]-2-pyridinyl]-2,2-dimethylpropanamide
SMILESCOc1ccccc1P(c1ccccc1)c1cccc(NC(=O)C(C)(C)C)n1
InChIInChI=1S/C23H25N2O2P/c1-23(2,3)22(26)25-20-15-10-16-21(24-20)28(17-11-6-5-7-12-17)19-14-9-8-13-18(19)27-4/h5-16H,1-4H3,(H,24,25,26)
InChIKeyQZSLJYODDDUCPW-UHFFFAOYSA-N
XLogP3.83
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.44
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2,2-dimethyl-N-[6-[(2-methylphenyl)-phenylphosphanyl]-2-pyridinyl]propanamide
CID 102181081
N-[6-bis(3,5-diethylphenyl)phosphanyl-2-pyridinyl]-2,2-dimethylpropanamide
CID 87356862
acetic acid;[2-(2-diphenylphosphanyl-6-methoxyphenyl)-3-methoxyphenyl]-diphenylphosphane;ruthenium
CID 10865680
N-[6-(2-methoxyanilino)pyridazin-3-yl]-2,2-dimethylpropanamide
CID 113048089
2,2-dimethyl-N-(6-phosphanyl-2-pyridinyl)propanamide
CID 70898428
2-diphenylphosphanyl-6-methoxyphenol
CID 58759318
2,2-dimethyl-N-[6-(nitrosomethyl)-2-pyridinyl]propanamide
CID 90865597
2-bis(2-methoxyphenyl)phosphanyl-6-tert-butylphenol
CID 58660014
[2-(2-diphenylphosphanyl-6-methoxyphenyl)-3-methoxyphenyl]-diphenylphosphane;sulfane
CID 134828499
N-[6-[(4-fluorophenyl)methoxymethyl]-2-pyridinyl]-2,2-dimethylpropanamide
CID 68842438
N-(2-methoxyphenyl)-N'-(6-methyl-2-pyridinyl)oxamide
CID 44997668
CID 57341193
CID 57341193

Frequently Asked Questions

What is the IUPAC name of N-[6-[(2-methoxyphenyl)-phenylphosphanyl]-2-pyridinyl]-2,2-dimethylpropanamide?
The IUPAC name of N-[6-[(2-methoxyphenyl)-phenylphosphanyl]-2-pyridinyl]-2,2-dimethylpropanamide (CID 102181078) is N-[6-[(2-methoxyphenyl)-phenylphosphanyl]-2-pyridinyl]-2,2-dimethylpropanamide.
What is the SMILES notation for N-[6-[(2-methoxyphenyl)-phenylphosphanyl]-2-pyridinyl]-2,2-dimethylpropanamide?
The canonical SMILES for N-[6-[(2-methoxyphenyl)-phenylphosphanyl]-2-pyridinyl]-2,2-dimethylpropanamide is COc1ccccc1P(c1ccccc1)c1cccc(NC(=O)C(C)(C)C)n1.
What is the InChIKey of N-[6-[(2-methoxyphenyl)-phenylphosphanyl]-2-pyridinyl]-2,2-dimethylpropanamide?
The InChIKey is QZSLJYODDDUCPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N2O2P/c1-23(2,3)22(26)25-20-15-10-16-21(24-20)28(17-11-6-5-7-12-17)19-14-9-8-13-18(19)27-4/h5-16H,1-4H3,(H,24,25,26).
What are the key properties of N-[6-[(2-methoxyphenyl)-phenylphosphanyl]-2-pyridinyl]-2,2-dimethylpropanamide?
N-[6-[(2-methoxyphenyl)-phenylphosphanyl]-2-pyridinyl]-2,2-dimethylpropanamide has a molecular weight of 392.44 g/mol, XLogP of 3.83, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[(2-methoxyphenyl)-phenylphosphanyl]-2-pyridinyl]-2,2-dimethylpropanamide is sourced from PubChem (CID 102181078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).