4-fluoro-N-[2-[(4-fluorobenzoyl)amino]cyclohexyl]benzamide

C20H20F2N2O2 — CID 2912791

IUPAC4-fluoro-N-[2-[(4-fluorobenzoyl)amino]cyclohexyl]benzamide
SMILESO=C(NC1CCCCC1NC(=O)c1ccc(F)cc1)c1ccc(F)cc1
InChIInChI=1S/C20H20F2N2O2/c21-15-9-5-13(6-10-15)19(25)23-17-3-1-2-4-18(17)24-20(26)14-7-11-16(22)12-8-14/h5-12,17-18H,1-4H2,(H,23,25)(H,24,26)
InChIKeyAZZKIHGTULUMMR-UHFFFAOYSA-N
MW358.39 g/mol
LogP3.44
Rot. Bonds4

About 4-fluoro-N-[2-[(4-fluorobenzoyl)amino]cyclohexyl]benzamide

4-fluoro-N-[2-[(4-fluorobenzoyl)amino]cyclohexyl]benzamide (PubChem CID 2912791) has the molecular formula C20H20F2N2O2 and a molecular weight of 358.39 g/mol. Its IUPAC name is 4-fluoro-N-[2-[(4-fluorobenzoyl)amino]cyclohexyl]benzamide.

Molecular Properties

Compound Name4-fluoro-N-[2-[(4-fluorobenzoyl)amino]cyclohexyl]benzamide
PubChem CID2912791
Molecular FormulaC20H20F2N2O2
Molecular Weight358.39 g/mol
Exact Mass358.15
IUPAC Name4-fluoro-N-[2-[(4-fluorobenzoyl)amino]cyclohexyl]benzamide
SMILESO=C(NC1CCCCC1NC(=O)c1ccc(F)cc1)c1ccc(F)cc1
InChIInChI=1S/C20H20F2N2O2/c21-15-9-5-13(6-10-15)19(25)23-17-3-1-2-4-18(17)24-20(26)14-7-11-16(22)12-8-14/h5-12,17-18H,1-4H2,(H,23,25)(H,24,26)
InChIKeyAZZKIHGTULUMMR-UHFFFAOYSA-N
XLogP3.44
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.39
LogP ≤ 53.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-fluoro-N-[(1R,2S)-2-methylcyclohexyl]benzamide
CID 2098476
N-[2-(chloromethyl)cyclohexyl]-4-fluorobenzamide
CID 114179591
4-fluoro-N-[(1R,2R,3R)-2-hydroxy-3-pyrrolidin-1-ylcycloheptyl]benzamide
CID 110128189
N-[2-[(dimethylamino)methyl]cyclohexyl]-4-fluorobenzamide
CID 110279233
4-tert-butyl-N-[(1R,2S)-2-[(4-tert-butylbenzoyl)amino]cyclohexyl]benzamide
CID 7311333
1-N,4-N-bis[(1S,2R)-2-methylcyclohexyl]benzene-1,4-dicarboxamide
CID 124805645
N-[2-[(2-chlorophenyl)methylcarbamoylamino]cyclohexyl]-4-fluorobenzamide
CID 23826641
N-[(1R,2S)-2-[[4-(diethylamino)phenyl]methylamino]cyclohexyl]-4-fluorobenzamide
CID 90644987
N-[(1R,2R)-2-[(3,4-dihydroxybenzoyl)amino]cyclohexyl]-3,4-dihydroxybenzamide
CID 10091534
3,5-difluoro-N-(2-hydroxycyclohexyl)benzamide
CID 55063928
4-bromo-N-(2-hydroxycyclohexyl)benzamide
CID 3294155
N-(2-hydroxycyclohexyl)-4-iodobenzamide
CID 62365415

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-[2-[(4-fluorobenzoyl)amino]cyclohexyl]benzamide?
The IUPAC name of 4-fluoro-N-[2-[(4-fluorobenzoyl)amino]cyclohexyl]benzamide (CID 2912791) is 4-fluoro-N-[2-[(4-fluorobenzoyl)amino]cyclohexyl]benzamide.
What is the SMILES notation for 4-fluoro-N-[2-[(4-fluorobenzoyl)amino]cyclohexyl]benzamide?
The canonical SMILES for 4-fluoro-N-[2-[(4-fluorobenzoyl)amino]cyclohexyl]benzamide is O=C(NC1CCCCC1NC(=O)c1ccc(F)cc1)c1ccc(F)cc1.
What is the InChIKey of 4-fluoro-N-[2-[(4-fluorobenzoyl)amino]cyclohexyl]benzamide?
The InChIKey is AZZKIHGTULUMMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20F2N2O2/c21-15-9-5-13(6-10-15)19(25)23-17-3-1-2-4-18(17)24-20(26)14-7-11-16(22)12-8-14/h5-12,17-18H,1-4H2,(H,23,25)(H,24,26).
What are the key properties of 4-fluoro-N-[2-[(4-fluorobenzoyl)amino]cyclohexyl]benzamide?
4-fluoro-N-[2-[(4-fluorobenzoyl)amino]cyclohexyl]benzamide has a molecular weight of 358.39 g/mol, XLogP of 3.44, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-[2-[(4-fluorobenzoyl)amino]cyclohexyl]benzamide is sourced from PubChem (CID 2912791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).