2-cyclohexyl-N-[(4-fluorophenyl)methyl]acetamide

C15H20FNO — CID 1121612

IUPAC2-cyclohexyl-N-[(4-fluorophenyl)methyl]acetamide
SMILESO=C(CC1CCCCC1)NCc1ccc(F)cc1
InChIInChI=1S/C15H20FNO/c16-14-8-6-13(7-9-14)11-17-15(18)10-12-4-2-1-3-5-12/h6-9,12H,1-5,10-11H2,(H,17,18)
InChIKeyKUUFIEGMAAAYHB-UHFFFAOYSA-N
MW249.33 g/mol
LogP3.41
Rot. Bonds4

About 2-cyclohexyl-N-[(4-fluorophenyl)methyl]acetamide

2-cyclohexyl-N-[(4-fluorophenyl)methyl]acetamide (PubChem CID 1121612) has the molecular formula C15H20FNO and a molecular weight of 249.33 g/mol. Its IUPAC name is 2-cyclohexyl-N-[(4-fluorophenyl)methyl]acetamide.

Molecular Properties

Compound Name2-cyclohexyl-N-[(4-fluorophenyl)methyl]acetamide
PubChem CID1121612
Molecular FormulaC15H20FNO
Molecular Weight249.33 g/mol
Exact Mass249.15
IUPAC Name2-cyclohexyl-N-[(4-fluorophenyl)methyl]acetamide
SMILESO=C(CC1CCCCC1)NCc1ccc(F)cc1
InChIInChI=1S/C15H20FNO/c16-14-8-6-13(7-9-14)11-17-15(18)10-12-4-2-1-3-5-12/h6-9,12H,1-5,10-11H2,(H,17,18)
InChIKeyKUUFIEGMAAAYHB-UHFFFAOYSA-N
XLogP3.41
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.33
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-N-[(4-fluorophenyl)methyl]acetamide?
The IUPAC name of 2-cyclohexyl-N-[(4-fluorophenyl)methyl]acetamide (CID 1121612) is 2-cyclohexyl-N-[(4-fluorophenyl)methyl]acetamide.
What is the SMILES notation for 2-cyclohexyl-N-[(4-fluorophenyl)methyl]acetamide?
The canonical SMILES for 2-cyclohexyl-N-[(4-fluorophenyl)methyl]acetamide is O=C(CC1CCCCC1)NCc1ccc(F)cc1.
What is the InChIKey of 2-cyclohexyl-N-[(4-fluorophenyl)methyl]acetamide?
The InChIKey is KUUFIEGMAAAYHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20FNO/c16-14-8-6-13(7-9-14)11-17-15(18)10-12-4-2-1-3-5-12/h6-9,12H,1-5,10-11H2,(H,17,18).
What are the key properties of 2-cyclohexyl-N-[(4-fluorophenyl)methyl]acetamide?
2-cyclohexyl-N-[(4-fluorophenyl)methyl]acetamide has a molecular weight of 249.33 g/mol, XLogP of 3.41, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-N-[(4-fluorophenyl)methyl]acetamide is sourced from PubChem (CID 1121612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).