2,2-dimethyl-N-[6-[(2-methylphenyl)-phenylphosphanyl]-2-pyridinyl]propanamide

C23H25N2OP — CID 102181081

IUPAC2,2-dimethyl-N-[6-[(2-methylphenyl)-phenylphosphanyl]-2-pyridinyl]propanamide
SMILESCc1ccccc1P(c1ccccc1)c1cccc(NC(=O)C(C)(C)C)n1
InChIInChI=1S/C23H25N2OP/c1-17-11-8-9-14-19(17)27(18-12-6-5-7-13-18)21-16-10-15-20(24-21)25-22(26)23(2,3)4/h5-16H,1-4H3,(H,24,25,26)
InChIKeyVJGWKYGLSWFKAQ-UHFFFAOYSA-N
MW376.44 g/mol
LogP4.13
Rot. Bonds4

About 2,2-dimethyl-N-[6-[(2-methylphenyl)-phenylphosphanyl]-2-pyridinyl]propanamide

2,2-dimethyl-N-[6-[(2-methylphenyl)-phenylphosphanyl]-2-pyridinyl]propanamide (PubChem CID 102181081) has the molecular formula C23H25N2OP and a molecular weight of 376.44 g/mol. Its IUPAC name is 2,2-dimethyl-N-[6-[(2-methylphenyl)-phenylphosphanyl]-2-pyridinyl]propanamide.

Molecular Properties

Compound Name2,2-dimethyl-N-[6-[(2-methylphenyl)-phenylphosphanyl]-2-pyridinyl]propanamide
PubChem CID102181081
Molecular FormulaC23H25N2OP
Molecular Weight376.44 g/mol
Exact Mass376.17
IUPAC Name2,2-dimethyl-N-[6-[(2-methylphenyl)-phenylphosphanyl]-2-pyridinyl]propanamide
SMILESCc1ccccc1P(c1ccccc1)c1cccc(NC(=O)C(C)(C)C)n1
InChIInChI=1S/C23H25N2OP/c1-17-11-8-9-14-19(17)27(18-12-6-5-7-13-18)21-16-10-15-20(24-21)25-22(26)23(2,3)4/h5-16H,1-4H3,(H,24,25,26)
InChIKeyVJGWKYGLSWFKAQ-UHFFFAOYSA-N
XLogP4.13
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.44
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2,2-dimethyl-N-[6-[(2-methylphenyl)-phenylphosphanyl]-2-pyridinyl]propanamide 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-[6-[(2-methoxyphenyl)-phenylphosphanyl]-2-pyridinyl]-2,2-dimethylpropanamide
CID 102181078
N-[6-bis(3,5-diethylphenyl)phosphanyl-2-pyridinyl]-2,2-dimethylpropanamide
CID 87356862
2,2-dimethyl-N-(6-phosphanyl-2-pyridinyl)propanamide
CID 70898428
N-[6-[bis(diethylamino)phosphanyl]-2-pyridinyl]-2,2-dimethylpropanamide;N-(6-bromo-2-pyridinyl)-2,2-dimethylpropanamide
CID 158257550
2,2-dimethyl-N-[6-(nitrosomethyl)-2-pyridinyl]propanamide
CID 90865597
N-tert-butyl-1-[6-(2,2-dimethylpropanoylamino)-2-pyridinyl]methanimine oxide
CID 59013576
2,2,2-trifluoroacetic acid;tris(2-methylphenyl)phosphane
CID 174418794
2,2-dimethyl-N-(3-methyl-2-pyridinyl)propanamide
CID 1479965
N-[6-(2,2-dimethylpropanoylamino)-2-pyridinyl]-4-ethenylbenzamide
CID 102139348
N-[6-(azidomethyl)-2-pyridinyl]-2,2-dimethylpropanamide
CID 15541065
3-chloro-N-[6-[(3-chloro-2,2-dimethylpropanoyl)amino]-2-pyridinyl]-2,2-dimethylpropanamide
CID 2767546
2-(2,2-dimethylpropanoylamino)-6-methylbenzoate
CID 102356680

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-[6-[(2-methylphenyl)-phenylphosphanyl]-2-pyridinyl]propanamide?
The IUPAC name of 2,2-dimethyl-N-[6-[(2-methylphenyl)-phenylphosphanyl]-2-pyridinyl]propanamide (CID 102181081) is 2,2-dimethyl-N-[6-[(2-methylphenyl)-phenylphosphanyl]-2-pyridinyl]propanamide.
What is the SMILES notation for 2,2-dimethyl-N-[6-[(2-methylphenyl)-phenylphosphanyl]-2-pyridinyl]propanamide?
The canonical SMILES for 2,2-dimethyl-N-[6-[(2-methylphenyl)-phenylphosphanyl]-2-pyridinyl]propanamide is Cc1ccccc1P(c1ccccc1)c1cccc(NC(=O)C(C)(C)C)n1.
What is the InChIKey of 2,2-dimethyl-N-[6-[(2-methylphenyl)-phenylphosphanyl]-2-pyridinyl]propanamide?
The InChIKey is VJGWKYGLSWFKAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N2OP/c1-17-11-8-9-14-19(17)27(18-12-6-5-7-13-18)21-16-10-15-20(24-21)25-22(26)23(2,3)4/h5-16H,1-4H3,(H,24,25,26).
What are the key properties of 2,2-dimethyl-N-[6-[(2-methylphenyl)-phenylphosphanyl]-2-pyridinyl]propanamide?
2,2-dimethyl-N-[6-[(2-methylphenyl)-phenylphosphanyl]-2-pyridinyl]propanamide has a molecular weight of 376.44 g/mol, XLogP of 4.13, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-[6-[(2-methylphenyl)-phenylphosphanyl]-2-pyridinyl]propanamide is sourced from PubChem (CID 102181081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).