carbanide;N-(4-fluoro-2,6-dimethylphenyl)pentanamide;platinum

C15H23FNOPt-3 — CID 156737620

IUPACcarbanide;N-(4-fluoro-2,6-dimethylphenyl)pentanamide;platinum
SMILESCCC[CH-]C(=O)Nc1c(C)cc(F)cc1C.[CH3-].[CH3-].[Pt]
InChIInChI=1S/C13H17FNO.2CH3.Pt/c1-4-5-6-12(16)15-13-9(2)7-11(14)8-10(13)3;;;/h6-8H,4-5H2,1-3H3,(H,15,16);2*1H3;/q3*-1;
InChIKeyLXJSJJLBBACVQC-UHFFFAOYSA-N
MW447.43 g/mol
LogP4.28
Rot. Bonds4

About carbanide;N-(4-fluoro-2,6-dimethylphenyl)pentanamide;platinum

carbanide;N-(4-fluoro-2,6-dimethylphenyl)pentanamide;platinum (PubChem CID 156737620) has the molecular formula C15H23FNOPt-3 and a molecular weight of 447.43 g/mol. Its IUPAC name is carbanide;N-(4-fluoro-2,6-dimethylphenyl)pentanamide;platinum.

Molecular Properties

Compound Namecarbanide;N-(4-fluoro-2,6-dimethylphenyl)pentanamide;platinum
PubChem CID156737620
Molecular FormulaC15H23FNOPt-3
Molecular Weight447.43 g/mol
Exact Mass447.14
IUPAC Namecarbanide;N-(4-fluoro-2,6-dimethylphenyl)pentanamide;platinum
SMILESCCC[CH-]C(=O)Nc1c(C)cc(F)cc1C.[CH3-].[CH3-].[Pt]
InChIInChI=1S/C13H17FNO.2CH3.Pt/c1-4-5-6-12(16)15-13-9(2)7-11(14)8-10(13)3;;;/h6-8H,4-5H2,1-3H3,(H,15,16);2*1H3;/q3*-1;
InChIKeyLXJSJJLBBACVQC-UHFFFAOYSA-N
XLogP4.28
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500447.43
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

carbanide;N-(2,6-dimethylphenyl)pentanamide;platinum
CID 156737601
N-(4-fluoro-2,6-dimethylphenyl)propanamide;yttrium
CID 159722509
butyl-[1-[(4-fluoro-2,6-dimethylphenyl)carbamoyl]cyclobutyl]-methyl-propylazanium
CID 155693230
1-(2,4-difluoro-6-methylphenyl)-3-ethoxyurea
CID 134178081
[1-(4-fluoro-2,6-dimethylanilino)-1-oxobutan-2-yl]-dimethyl-sulfidoazanium
CID 155692415
ethane;N-(4-fluoro-2,6-dimethylphenyl)-2,3-dipropyloctanamide;methanamine
CID 155693316
ethyl-[1-[(4-fluoro-2,6-dimethylphenyl)carbamoyl]cyclopropyl]-dimethylphosphanium;yttrium
CID 159651489
N-(4-fluoro-2,6-dimethylphenyl)hydroxylamine
CID 24834488
ethane;N-(4-fluoro-2,6-dimethylphenyl)-2-(1-methylpyrrolidin-1-ium-1-yl)pentanamide
CID 155693361
diethyl-ethyl-[1-[(4-fluoro-2,6-dimethylphenyl)carbamoyl]cyclobutyl]phosphanium
CID 158204079
(2S)-2-amino-N-(2,4,6-trifluorophenyl)hexanamide
CID 107145817
2-(1-ethylphosphepan-1-ium-1-yl)-N-(4-fluoro-2,6-dimethylphenyl)acetamide;yttrium
CID 159170145

Frequently Asked Questions

What is the IUPAC name of carbanide;N-(4-fluoro-2,6-dimethylphenyl)pentanamide;platinum?
The IUPAC name of carbanide;N-(4-fluoro-2,6-dimethylphenyl)pentanamide;platinum (CID 156737620) is carbanide;N-(4-fluoro-2,6-dimethylphenyl)pentanamide;platinum.
What is the SMILES notation for carbanide;N-(4-fluoro-2,6-dimethylphenyl)pentanamide;platinum?
The canonical SMILES for carbanide;N-(4-fluoro-2,6-dimethylphenyl)pentanamide;platinum is CCC[CH-]C(=O)Nc1c(C)cc(F)cc1C.[CH3-].[CH3-].[Pt].
What is the InChIKey of carbanide;N-(4-fluoro-2,6-dimethylphenyl)pentanamide;platinum?
The InChIKey is LXJSJJLBBACVQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17FNO.2CH3.Pt/c1-4-5-6-12(16)15-13-9(2)7-11(14)8-10(13)3;;;/h6-8H,4-5H2,1-3H3,(H,15,16);2*1H3;/q3*-1;.
What are the key properties of carbanide;N-(4-fluoro-2,6-dimethylphenyl)pentanamide;platinum?
carbanide;N-(4-fluoro-2,6-dimethylphenyl)pentanamide;platinum has a molecular weight of 447.43 g/mol, XLogP of 4.28, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;N-(4-fluoro-2,6-dimethylphenyl)pentanamide;platinum is sourced from PubChem (CID 156737620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).