3-N-cyclopentyl-1-N-(2,4-difluorophenyl)benzene-1,3-dicarboxamide

C19H18F2N2O2 — CID 109051946

IUPAC3-N-cyclopentyl-1-N-(2,4-difluorophenyl)benzene-1,3-dicarboxamide
SMILESO=C(Nc1ccc(F)cc1F)c1cccc(C(=O)NC2CCCC2)c1
InChIInChI=1S/C19H18F2N2O2/c20-14-8-9-17(16(21)11-14)23-19(25)13-5-3-4-12(10-13)18(24)22-15-6-1-2-7-15/h3-5,8-11,15H,1-2,6-7H2,(H,22,24)(H,23,25)
InChIKeyDBBIENPEEKUPQV-UHFFFAOYSA-N
MW344.36 g/mol
LogP3.89
Rot. Bonds4

About 3-N-cyclopentyl-1-N-(2,4-difluorophenyl)benzene-1,3-dicarboxamide

3-N-cyclopentyl-1-N-(2,4-difluorophenyl)benzene-1,3-dicarboxamide (PubChem CID 109051946) has the molecular formula C19H18F2N2O2 and a molecular weight of 344.36 g/mol. Its IUPAC name is 3-N-cyclopentyl-1-N-(2,4-difluorophenyl)benzene-1,3-dicarboxamide.

Molecular Properties

Compound Name3-N-cyclopentyl-1-N-(2,4-difluorophenyl)benzene-1,3-dicarboxamide
PubChem CID109051946
Molecular FormulaC19H18F2N2O2
Molecular Weight344.36 g/mol
Exact Mass344.13
IUPAC Name3-N-cyclopentyl-1-N-(2,4-difluorophenyl)benzene-1,3-dicarboxamide
SMILESO=C(Nc1ccc(F)cc1F)c1cccc(C(=O)NC2CCCC2)c1
InChIInChI=1S/C19H18F2N2O2/c20-14-8-9-17(16(21)11-14)23-19(25)13-5-3-4-12(10-13)18(24)22-15-6-1-2-7-15/h3-5,8-11,15H,1-2,6-7H2,(H,22,24)(H,23,25)
InChIKeyDBBIENPEEKUPQV-UHFFFAOYSA-N
XLogP3.89
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.36
LogP ≤ 53.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-N-cyclopentyl-1-N-(2,3,4-trifluorophenyl)benzene-1,3-dicarboxamide
CID 109051962
4-N-cyclohexyl-2-N-(2,4-difluorophenyl)pyridine-2,4-dicarboxamide
CID 109081485
6-N-cyclohexyl-2-N-(2,4-difluorophenyl)pyridine-2,6-dicarboxamide
CID 109095391
3-N-(2,4-difluorophenyl)-1-N-(3-fluorophenyl)benzene-1,3-dicarboxamide
CID 109057757
1-N-cyclohexyl-4-N-(2-fluorophenyl)benzene-1,4-dicarboxamide
CID 109044796
3-N-cyclopentyl-1-N-(2,3-dichlorophenyl)benzene-1,3-dicarboxamide
CID 109051954
5-N-cycloheptyl-3-N-(2-fluorophenyl)pyridine-3,5-dicarboxamide
CID 109107049
1-N,4-N-bis(2,4-difluorophenyl)benzene-1,4-dicarboxamide
CID 3596826
N-(2,4-difluorophenyl)-3-[(Z)-N'-hydroxycarbamimidoyl]benzamide
CID 43156113
1-N-(4-chlorophenyl)-3-N-cycloheptylbenzene-1,3-dicarboxamide
CID 109056113
3-N-cyclohexyl-1-N-(2,4-dimethoxyphenyl)benzene-1,3-dicarboxamide
CID 109052232
1-N-(2-cyanophenyl)-3-N-(2,4-difluorophenyl)benzene-1,3-dicarboxamide
CID 109057784

Frequently Asked Questions

What is the IUPAC name of 3-N-cyclopentyl-1-N-(2,4-difluorophenyl)benzene-1,3-dicarboxamide?
The IUPAC name of 3-N-cyclopentyl-1-N-(2,4-difluorophenyl)benzene-1,3-dicarboxamide (CID 109051946) is 3-N-cyclopentyl-1-N-(2,4-difluorophenyl)benzene-1,3-dicarboxamide.
What is the SMILES notation for 3-N-cyclopentyl-1-N-(2,4-difluorophenyl)benzene-1,3-dicarboxamide?
The canonical SMILES for 3-N-cyclopentyl-1-N-(2,4-difluorophenyl)benzene-1,3-dicarboxamide is O=C(Nc1ccc(F)cc1F)c1cccc(C(=O)NC2CCCC2)c1.
What is the InChIKey of 3-N-cyclopentyl-1-N-(2,4-difluorophenyl)benzene-1,3-dicarboxamide?
The InChIKey is DBBIENPEEKUPQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18F2N2O2/c20-14-8-9-17(16(21)11-14)23-19(25)13-5-3-4-12(10-13)18(24)22-15-6-1-2-7-15/h3-5,8-11,15H,1-2,6-7H2,(H,22,24)(H,23,25).
What are the key properties of 3-N-cyclopentyl-1-N-(2,4-difluorophenyl)benzene-1,3-dicarboxamide?
3-N-cyclopentyl-1-N-(2,4-difluorophenyl)benzene-1,3-dicarboxamide has a molecular weight of 344.36 g/mol, XLogP of 3.89, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-cyclopentyl-1-N-(2,4-difluorophenyl)benzene-1,3-dicarboxamide is sourced from PubChem (CID 109051946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).