N-(2,2-dimethyl-1-phenylphosphanylidenepropyl)-N-phenylbenzamide

C24H24NOP — CID 134920323

IUPACN-(2,2-dimethyl-1-phenylphosphanylidenepropyl)-N-phenylbenzamide
SMILESCC(C)(C)/C(=P\c1ccccc1)N(C(=O)c1ccccc1)c1ccccc1
InChIInChI=1S/C24H24NOP/c1-24(2,3)23(27-21-17-11-6-12-18-21)25(20-15-9-5-10-16-20)22(26)19-13-7-4-8-14-19/h4-18H,1-3H3
InChIKeyLBROCDYHYUQNJZ-UHFFFAOYSA-N
MW373.44 g/mol
LogP5.78
Rot. Bonds4

About N-(2,2-dimethyl-1-phenylphosphanylidenepropyl)-N-phenylbenzamide

N-(2,2-dimethyl-1-phenylphosphanylidenepropyl)-N-phenylbenzamide (PubChem CID 134920323) has the molecular formula C24H24NOP and a molecular weight of 373.44 g/mol. Its IUPAC name is N-(2,2-dimethyl-1-phenylphosphanylidenepropyl)-N-phenylbenzamide.

Molecular Properties

Compound NameN-(2,2-dimethyl-1-phenylphosphanylidenepropyl)-N-phenylbenzamide
PubChem CID134920323
Molecular FormulaC24H24NOP
Molecular Weight373.44 g/mol
Exact Mass373.16
IUPAC NameN-(2,2-dimethyl-1-phenylphosphanylidenepropyl)-N-phenylbenzamide
SMILESCC(C)(C)/C(=P\c1ccccc1)N(C(=O)c1ccccc1)c1ccccc1
InChIInChI=1S/C24H24NOP/c1-24(2,3)23(27-21-17-11-6-12-18-21)25(20-15-9-5-10-16-20)22(26)19-13-7-4-8-14-19/h4-18H,1-3H3
InChIKeyLBROCDYHYUQNJZ-UHFFFAOYSA-N
XLogP5.78
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500373.44
LogP ≤ 55.78
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

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CID 171577154
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4-[acetyl(benzoyl)amino]benzoic acid
CID 138333706
N-phenyl-N-(trifluoromethylcarbamoyl)benzamide
CID 70182203
N-bromo-N-tert-butylbenzamide
CID 141466989
N-(ethylcarbamothioyl)-N-phenylbenzamide
CID 57059223
N-[1-(N-benzoyl-4-methylanilino)ethenyl]-N-(4-methylphenyl)benzamide
CID 13213795
benzoic acid;N-methyl-N-phenylaniline
CID 158055475
N-hydroxy-N-phenylbenzamide;tungsten
CID 159148219
acetic acid;N-tert-butyl-N-hydroxybenzamide
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N-[3-[benzoyl(methyl)amino]phenyl]-N-methylbenzamide
CID 59642334

Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethyl-1-phenylphosphanylidenepropyl)-N-phenylbenzamide?
The IUPAC name of N-(2,2-dimethyl-1-phenylphosphanylidenepropyl)-N-phenylbenzamide (CID 134920323) is N-(2,2-dimethyl-1-phenylphosphanylidenepropyl)-N-phenylbenzamide.
What is the SMILES notation for N-(2,2-dimethyl-1-phenylphosphanylidenepropyl)-N-phenylbenzamide?
The canonical SMILES for N-(2,2-dimethyl-1-phenylphosphanylidenepropyl)-N-phenylbenzamide is CC(C)(C)/C(=P\c1ccccc1)N(C(=O)c1ccccc1)c1ccccc1.
What is the InChIKey of N-(2,2-dimethyl-1-phenylphosphanylidenepropyl)-N-phenylbenzamide?
The InChIKey is LBROCDYHYUQNJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24NOP/c1-24(2,3)23(27-21-17-11-6-12-18-21)25(20-15-9-5-10-16-20)22(26)19-13-7-4-8-14-19/h4-18H,1-3H3.
What are the key properties of N-(2,2-dimethyl-1-phenylphosphanylidenepropyl)-N-phenylbenzamide?
N-(2,2-dimethyl-1-phenylphosphanylidenepropyl)-N-phenylbenzamide has a molecular weight of 373.44 g/mol, XLogP of 5.78, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethyl-1-phenylphosphanylidenepropyl)-N-phenylbenzamide is sourced from PubChem (CID 134920323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).