N-(cyclohexylmethyl)-3-(2-fluorophenyl)propanamide

C16H22FNO — CID 95899940

IUPACN-(cyclohexylmethyl)-3-(2-fluorophenyl)propanamide
SMILESO=C(CCc1ccccc1F)NCC1CCCCC1
InChIInChI=1S/C16H22FNO/c17-15-9-5-4-8-14(15)10-11-16(19)18-12-13-6-2-1-3-7-13/h4-5,8-9,13H,1-3,6-7,10-12H2,(H,18,19)
InChIKeyFVFMYLSVPSJQKT-UHFFFAOYSA-N
MW263.36 g/mol
LogP3.45
Rot. Bonds5

About N-(cyclohexylmethyl)-3-(2-fluorophenyl)propanamide

N-(cyclohexylmethyl)-3-(2-fluorophenyl)propanamide (PubChem CID 95899940) has the molecular formula C16H22FNO and a molecular weight of 263.36 g/mol. Its IUPAC name is N-(cyclohexylmethyl)-3-(2-fluorophenyl)propanamide.

Molecular Properties

Compound NameN-(cyclohexylmethyl)-3-(2-fluorophenyl)propanamide
PubChem CID95899940
Molecular FormulaC16H22FNO
Molecular Weight263.36 g/mol
Exact Mass263.17
IUPAC NameN-(cyclohexylmethyl)-3-(2-fluorophenyl)propanamide
SMILESO=C(CCc1ccccc1F)NCC1CCCCC1
InChIInChI=1S/C16H22FNO/c17-15-9-5-4-8-14(15)10-11-16(19)18-12-13-6-2-1-3-7-13/h4-5,8-9,13H,1-3,6-7,10-12H2,(H,18,19)
InChIKeyFVFMYLSVPSJQKT-UHFFFAOYSA-N
XLogP3.45
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.36
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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N-(cyclopentylmethyl)-4-(2-fluorophenyl)-4-oxobutanamide
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N-[(1-cyclopropyl-5-oxopyrrolidin-3-yl)methyl]-3-(2-fluorophenyl)propanamide
CID 110719906
N-(cycloheptylmethyl)-2-phenylacetamide
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3-(2-fluorophenyl)-N-[[1-(4-methylthiadiazole-5-carbonyl)piperidin-4-yl]methyl]propanamide
CID 71806832
3-(cyclohexylcarbamoylamino)-N-[2-(2-fluorophenyl)ethyl]propanamide
CID 18152351
N-(cyclohexylmethyl)-3-(3-phenyl-1,2-oxazol-4-yl)propanamide
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[3-[4-[[3-(2-fluorophenyl)propanoylamino]methyl]piperidine-1-carbonyl]phenyl] acetate
CID 108927294
N-(cyclohexylmethyl)-2-(4-fluorophenyl)acetamide
CID 83278373
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CID 51076426

Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylmethyl)-3-(2-fluorophenyl)propanamide?
The IUPAC name of N-(cyclohexylmethyl)-3-(2-fluorophenyl)propanamide (CID 95899940) is N-(cyclohexylmethyl)-3-(2-fluorophenyl)propanamide.
What is the SMILES notation for N-(cyclohexylmethyl)-3-(2-fluorophenyl)propanamide?
The canonical SMILES for N-(cyclohexylmethyl)-3-(2-fluorophenyl)propanamide is O=C(CCc1ccccc1F)NCC1CCCCC1.
What is the InChIKey of N-(cyclohexylmethyl)-3-(2-fluorophenyl)propanamide?
The InChIKey is FVFMYLSVPSJQKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22FNO/c17-15-9-5-4-8-14(15)10-11-16(19)18-12-13-6-2-1-3-7-13/h4-5,8-9,13H,1-3,6-7,10-12H2,(H,18,19).
What are the key properties of N-(cyclohexylmethyl)-3-(2-fluorophenyl)propanamide?
N-(cyclohexylmethyl)-3-(2-fluorophenyl)propanamide has a molecular weight of 263.36 g/mol, XLogP of 3.45, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylmethyl)-3-(2-fluorophenyl)propanamide is sourced from PubChem (CID 95899940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).