N-(tributyl-lambda5-phosphanylidene)benzamide

C19H32NOP — CID 14957418

IUPACN-(tributyl-lambda5-phosphanylidene)benzamide
SMILESCCCCP(CCCC)(CCCC)=NC(=O)c1ccccc1
InChIInChI=1S/C19H32NOP/c1-4-7-15-22(16-8-5-2,17-9-6-3)20-19(21)18-13-11-10-12-14-18/h10-14H,4-9,15-17H2,1-3H3
InChIKeyRAFJMYOFXFMCQA-UHFFFAOYSA-N
MW321.44 g/mol
LogP6.43
Rot. Bonds10

About N-(tributyl-lambda5-phosphanylidene)benzamide

N-(tributyl-lambda5-phosphanylidene)benzamide (PubChem CID 14957418) has the molecular formula C19H32NOP and a molecular weight of 321.44 g/mol. Its IUPAC name is N-(tributyl-lambda5-phosphanylidene)benzamide.

Molecular Properties

Compound NameN-(tributyl-lambda5-phosphanylidene)benzamide
PubChem CID14957418
Molecular FormulaC19H32NOP
Molecular Weight321.44 g/mol
Exact Mass321.22
IUPAC NameN-(tributyl-lambda5-phosphanylidene)benzamide
SMILESCCCCP(CCCC)(CCCC)=NC(=O)c1ccccc1
InChIInChI=1S/C19H32NOP/c1-4-7-15-22(16-8-5-2,17-9-6-3)20-19(21)18-13-11-10-12-14-18/h10-14H,4-9,15-17H2,1-3H3
InChIKeyRAFJMYOFXFMCQA-UHFFFAOYSA-N
XLogP6.43
TPSA29.43 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500321.44
LogP ≤ 56.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

hexane;1-phenylethanone
CID 160797049
N-decylidenebenzamide
CID 90984528
ethane;1-phenylpentan-1-one
CID 143728184
2-pentyl-1-phenylheptan-1-one
CID 67882345
butyl benzoate;dihydrochloride
CID 141031125
1,2-bis(dibutylphosphoryl)benzene
CID 138549467
benzoic acid;dibutylcarbamic acid
CID 160812669
ethane;propane;N-propan-2-ylidenebenzamide
CID 91020892
1-phenylheptadecan-1-one
CID 577626
benzoic acid;hexan-1-ol
CID 175334621
benzoic acid;hexan-1-ol
CID 163447913
benzoic acid;tridecan-1-ol
CID 67710151

Frequently Asked Questions

What is the IUPAC name of N-(tributyl-lambda5-phosphanylidene)benzamide?
The IUPAC name of N-(tributyl-lambda5-phosphanylidene)benzamide (CID 14957418) is N-(tributyl-lambda5-phosphanylidene)benzamide.
What is the SMILES notation for N-(tributyl-lambda5-phosphanylidene)benzamide?
The canonical SMILES for N-(tributyl-lambda5-phosphanylidene)benzamide is CCCCP(CCCC)(CCCC)=NC(=O)c1ccccc1.
What is the InChIKey of N-(tributyl-lambda5-phosphanylidene)benzamide?
The InChIKey is RAFJMYOFXFMCQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32NOP/c1-4-7-15-22(16-8-5-2,17-9-6-3)20-19(21)18-13-11-10-12-14-18/h10-14H,4-9,15-17H2,1-3H3.
What are the key properties of N-(tributyl-lambda5-phosphanylidene)benzamide?
N-(tributyl-lambda5-phosphanylidene)benzamide has a molecular weight of 321.44 g/mol, XLogP of 6.43, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(tributyl-lambda5-phosphanylidene)benzamide is sourced from PubChem (CID 14957418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).