N-(4-fluorophenyl)-2-(1-hydroxy-4-phenylcyclohexyl)propanamide

C21H24FNO2 — CID 121325029

IUPACN-(4-fluorophenyl)-2-(1-hydroxy-4-phenylcyclohexyl)propanamide
SMILESCC(C(=O)Nc1ccc(F)cc1)C1(O)CCC(c2ccccc2)CC1
InChIInChI=1S/C21H24FNO2/c1-15(20(24)23-19-9-7-18(22)8-10-19)21(25)13-11-17(12-14-21)16-5-3-2-4-6-16/h2-10,15,17,25H,11-14H2,1H3,(H,23,24)
InChIKeyKGDAAMGNBFJFFO-UHFFFAOYSA-N
MW341.43 g/mol
LogP4.49
Rot. Bonds4

About N-(4-fluorophenyl)-2-(1-hydroxy-4-phenylcyclohexyl)propanamide

N-(4-fluorophenyl)-2-(1-hydroxy-4-phenylcyclohexyl)propanamide (PubChem CID 121325029) has the molecular formula C21H24FNO2 and a molecular weight of 341.43 g/mol. Its IUPAC name is N-(4-fluorophenyl)-2-(1-hydroxy-4-phenylcyclohexyl)propanamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-2-(1-hydroxy-4-phenylcyclohexyl)propanamide
PubChem CID121325029
Molecular FormulaC21H24FNO2
Molecular Weight341.43 g/mol
Exact Mass341.18
IUPAC NameN-(4-fluorophenyl)-2-(1-hydroxy-4-phenylcyclohexyl)propanamide
SMILESCC(C(=O)Nc1ccc(F)cc1)C1(O)CCC(c2ccccc2)CC1
InChIInChI=1S/C21H24FNO2/c1-15(20(24)23-19-9-7-18(22)8-10-19)21(25)13-11-17(12-14-21)16-5-3-2-4-6-16/h2-10,15,17,25H,11-14H2,1H3,(H,23,24)
InChIKeyKGDAAMGNBFJFFO-UHFFFAOYSA-N
XLogP4.49
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.43
LogP ≤ 54.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-2-(1-hydroxy-4-phenylcyclohexyl)propanamide?
The IUPAC name of N-(4-fluorophenyl)-2-(1-hydroxy-4-phenylcyclohexyl)propanamide (CID 121325029) is N-(4-fluorophenyl)-2-(1-hydroxy-4-phenylcyclohexyl)propanamide.
What is the SMILES notation for N-(4-fluorophenyl)-2-(1-hydroxy-4-phenylcyclohexyl)propanamide?
The canonical SMILES for N-(4-fluorophenyl)-2-(1-hydroxy-4-phenylcyclohexyl)propanamide is CC(C(=O)Nc1ccc(F)cc1)C1(O)CCC(c2ccccc2)CC1.
What is the InChIKey of N-(4-fluorophenyl)-2-(1-hydroxy-4-phenylcyclohexyl)propanamide?
The InChIKey is KGDAAMGNBFJFFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24FNO2/c1-15(20(24)23-19-9-7-18(22)8-10-19)21(25)13-11-17(12-14-21)16-5-3-2-4-6-16/h2-10,15,17,25H,11-14H2,1H3,(H,23,24).
What are the key properties of N-(4-fluorophenyl)-2-(1-hydroxy-4-phenylcyclohexyl)propanamide?
N-(4-fluorophenyl)-2-(1-hydroxy-4-phenylcyclohexyl)propanamide has a molecular weight of 341.43 g/mol, XLogP of 4.49, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-2-(1-hydroxy-4-phenylcyclohexyl)propanamide is sourced from PubChem (CID 121325029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).