4-fluoro-N-(2-hydroxycyclohexyl)-N,2-dimethylbenzamide

C15H20FNO2 — CID 102631843

IUPAC4-fluoro-N-(2-hydroxycyclohexyl)-N,2-dimethylbenzamide
SMILESCc1cc(F)ccc1C(=O)N(C)C1CCCCC1O
InChIInChI=1S/C15H20FNO2/c1-10-9-11(16)7-8-12(10)15(19)17(2)13-5-3-4-6-14(13)18/h7-9,13-14,18H,3-6H2,1-2H3
InChIKeyNSKMPRPGHDMMDK-UHFFFAOYSA-N
MW265.33 g/mol
LogP2.51
Rot. Bonds2

About 4-fluoro-N-(2-hydroxycyclohexyl)-N,2-dimethylbenzamide

4-fluoro-N-(2-hydroxycyclohexyl)-N,2-dimethylbenzamide (PubChem CID 102631843) has the molecular formula C15H20FNO2 and a molecular weight of 265.33 g/mol. Its IUPAC name is 4-fluoro-N-(2-hydroxycyclohexyl)-N,2-dimethylbenzamide.

Molecular Properties

Compound Name4-fluoro-N-(2-hydroxycyclohexyl)-N,2-dimethylbenzamide
PubChem CID102631843
Molecular FormulaC15H20FNO2
Molecular Weight265.33 g/mol
Exact Mass265.15
IUPAC Name4-fluoro-N-(2-hydroxycyclohexyl)-N,2-dimethylbenzamide
SMILESCc1cc(F)ccc1C(=O)N(C)C1CCCCC1O
InChIInChI=1S/C15H20FNO2/c1-10-9-11(16)7-8-12(10)15(19)17(2)13-5-3-4-6-14(13)18/h7-9,13-14,18H,3-6H2,1-2H3
InChIKeyNSKMPRPGHDMMDK-UHFFFAOYSA-N
XLogP2.51
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.33
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-fluoro-N-(2-hydroxycyclohexyl)-N,2-dimethylbenzamide
CID 102635118
N-cycloheptyl-4-fluoro-N,2-dimethylbenzamide
CID 113268593
N-cyclobutyl-4-fluoro-N,2-dimethylbenzamide
CID 115745905
N-cyclopropyl-4-fluoro-N,2-dimethylbenzamide
CID 115745650
4-fluoro-N,2-dimethyl-N-(2-methyloxolan-3-yl)benzamide
CID 113399934
5-amino-2-fluoro-N-(2-hydroxycyclohexyl)-N,3-dimethylbenzamide
CID 103296931
3,4-difluoro-N-(2-hydroxycyclohexyl)-N-methylbenzamide
CID 102635266
4-fluoro-N,2-dimethyl-N-(3-methylcyclohexyl)benzamide
CID 112702414
4-fluoro-N,N,2-trimethylbenzamide
CID 115745346
2,6-difluoro-N-(2-hydroxycyclohexyl)-N,3-dimethylbenzamide
CID 102634808
2,4-dichloro-N-[(1R,2R)-2-hydroxycyclohexyl]-N-methylbenzamide
CID 19061812
2-hydroxy-N-(2-hydroxycyclohexyl)-N,5-dimethylbenzamide
CID 102632488

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-(2-hydroxycyclohexyl)-N,2-dimethylbenzamide?
The IUPAC name of 4-fluoro-N-(2-hydroxycyclohexyl)-N,2-dimethylbenzamide (CID 102631843) is 4-fluoro-N-(2-hydroxycyclohexyl)-N,2-dimethylbenzamide.
What is the SMILES notation for 4-fluoro-N-(2-hydroxycyclohexyl)-N,2-dimethylbenzamide?
The canonical SMILES for 4-fluoro-N-(2-hydroxycyclohexyl)-N,2-dimethylbenzamide is Cc1cc(F)ccc1C(=O)N(C)C1CCCCC1O.
What is the InChIKey of 4-fluoro-N-(2-hydroxycyclohexyl)-N,2-dimethylbenzamide?
The InChIKey is NSKMPRPGHDMMDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20FNO2/c1-10-9-11(16)7-8-12(10)15(19)17(2)13-5-3-4-6-14(13)18/h7-9,13-14,18H,3-6H2,1-2H3.
What are the key properties of 4-fluoro-N-(2-hydroxycyclohexyl)-N,2-dimethylbenzamide?
4-fluoro-N-(2-hydroxycyclohexyl)-N,2-dimethylbenzamide has a molecular weight of 265.33 g/mol, XLogP of 2.51, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-(2-hydroxycyclohexyl)-N,2-dimethylbenzamide is sourced from PubChem (CID 102631843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).