3,5-dichloro-N-fluoro-N-(2-methyl-5-phenylpentan-2-yl)benzamide

C19H20Cl2FNO — CID 162405173

IUPAC3,5-dichloro-N-fluoro-N-(2-methyl-5-phenylpentan-2-yl)benzamide
SMILESCC(C)(CCCc1ccccc1)N(F)C(=O)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C19H20Cl2FNO/c1-19(2,10-6-9-14-7-4-3-5-8-14)23(22)18(24)15-11-16(20)13-17(21)12-15/h3-5,7-8,11-13H,6,9-10H2,1-2H3
InChIKeyGLBNYCGDVKLPLD-UHFFFAOYSA-N
MW368.28 g/mol
LogP6.12
Rot. Bonds6

About 3,5-dichloro-N-fluoro-N-(2-methyl-5-phenylpentan-2-yl)benzamide

3,5-dichloro-N-fluoro-N-(2-methyl-5-phenylpentan-2-yl)benzamide (PubChem CID 162405173) has the molecular formula C19H20Cl2FNO and a molecular weight of 368.28 g/mol. Its IUPAC name is 3,5-dichloro-N-fluoro-N-(2-methyl-5-phenylpentan-2-yl)benzamide.

Molecular Properties

Compound Name3,5-dichloro-N-fluoro-N-(2-methyl-5-phenylpentan-2-yl)benzamide
PubChem CID162405173
Molecular FormulaC19H20Cl2FNO
Molecular Weight368.28 g/mol
Exact Mass367.09
IUPAC Name3,5-dichloro-N-fluoro-N-(2-methyl-5-phenylpentan-2-yl)benzamide
SMILESCC(C)(CCCc1ccccc1)N(F)C(=O)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C19H20Cl2FNO/c1-19(2,10-6-9-14-7-4-3-5-8-14)23(22)18(24)15-11-16(20)13-17(21)12-15/h3-5,7-8,11-13H,6,9-10H2,1-2H3
InChIKeyGLBNYCGDVKLPLD-UHFFFAOYSA-N
XLogP6.12
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500368.28
LogP ≤ 56.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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CID 118607347
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N-tert-butyl-3,5-dichlorobenzamide
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3-chloro-N-(4-fluorobenzyl)-N-methylbenzamide
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N'-tert-butyl-3,5-dichloro-N'-(2-chlorobenzoyl)benzohydrazide
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3-Chloro-N-cyclohexyl-N-ethylbenzamide
CID 587324
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Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-N-fluoro-N-(2-methyl-5-phenylpentan-2-yl)benzamide?
The IUPAC name of 3,5-dichloro-N-fluoro-N-(2-methyl-5-phenylpentan-2-yl)benzamide (CID 162405173) is 3,5-dichloro-N-fluoro-N-(2-methyl-5-phenylpentan-2-yl)benzamide.
What is the SMILES notation for 3,5-dichloro-N-fluoro-N-(2-methyl-5-phenylpentan-2-yl)benzamide?
The canonical SMILES for 3,5-dichloro-N-fluoro-N-(2-methyl-5-phenylpentan-2-yl)benzamide is CC(C)(CCCc1ccccc1)N(F)C(=O)c1cc(Cl)cc(Cl)c1.
What is the InChIKey of 3,5-dichloro-N-fluoro-N-(2-methyl-5-phenylpentan-2-yl)benzamide?
The InChIKey is GLBNYCGDVKLPLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20Cl2FNO/c1-19(2,10-6-9-14-7-4-3-5-8-14)23(22)18(24)15-11-16(20)13-17(21)12-15/h3-5,7-8,11-13H,6,9-10H2,1-2H3.
What are the key properties of 3,5-dichloro-N-fluoro-N-(2-methyl-5-phenylpentan-2-yl)benzamide?
3,5-dichloro-N-fluoro-N-(2-methyl-5-phenylpentan-2-yl)benzamide has a molecular weight of 368.28 g/mol, XLogP of 6.12, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-N-fluoro-N-(2-methyl-5-phenylpentan-2-yl)benzamide is sourced from PubChem (CID 162405173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).