N-cyclohexyl-2-[2-fluoro-4-(methylaminomethyl)phenoxy]acetamide

C16H23FN2O2 — CID 107686419

IUPACN-cyclohexyl-2-[2-fluoro-4-(methylaminomethyl)phenoxy]acetamide
SMILESCNCc1ccc(OCC(=O)NC2CCCCC2)c(F)c1
InChIInChI=1S/C16H23FN2O2/c1-18-10-12-7-8-15(14(17)9-12)21-11-16(20)19-13-5-3-2-4-6-13/h7-9,13,18H,2-6,10-11H2,1H3,(H,19,20)
InChIKeyQCWGPIDPSDRJME-UHFFFAOYSA-N
MW294.37 g/mol
LogP2.37
Rot. Bonds6

About N-cyclohexyl-2-[2-fluoro-4-(methylaminomethyl)phenoxy]acetamide

N-cyclohexyl-2-[2-fluoro-4-(methylaminomethyl)phenoxy]acetamide (PubChem CID 107686419) has the molecular formula C16H23FN2O2 and a molecular weight of 294.37 g/mol. Its IUPAC name is N-cyclohexyl-2-[2-fluoro-4-(methylaminomethyl)phenoxy]acetamide.

Molecular Properties

Compound NameN-cyclohexyl-2-[2-fluoro-4-(methylaminomethyl)phenoxy]acetamide
PubChem CID107686419
Molecular FormulaC16H23FN2O2
Molecular Weight294.37 g/mol
Exact Mass294.17
IUPAC NameN-cyclohexyl-2-[2-fluoro-4-(methylaminomethyl)phenoxy]acetamide
SMILESCNCc1ccc(OCC(=O)NC2CCCCC2)c(F)c1
InChIInChI=1S/C16H23FN2O2/c1-18-10-12-7-8-15(14(17)9-12)21-11-16(20)19-13-5-3-2-4-6-13/h7-9,13,18H,2-6,10-11H2,1H3,(H,19,20)
InChIKeyQCWGPIDPSDRJME-UHFFFAOYSA-N
XLogP2.37
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.37
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-fluoro-4-(methylaminomethyl)phenoxy]-N-propan-2-ylacetamide
CID 107686749
methyl 2-[2-fluoro-4-(methylaminomethyl)phenoxy]acetate
CID 107686567
1-[4-(cyclopentylmethoxy)-3-fluorophenyl]-N-methylmethanamine
CID 107686421
2-[2-fluoro-4-(methylaminomethyl)phenoxy]-N-phenylacetamide
CID 107686457
N-cycloheptyl-2-[2-(methylaminomethyl)phenoxy]acetamide
CID 62548783
2-[2-fluoro-4-(methylaminomethyl)phenoxy]-N-prop-2-enylacetamide
CID 107686453
2-[4-[(3-chloro-4-fluoroanilino)methyl]-2-methoxyphenoxy]-N-cyclohexylacetamide
CID 979525
N-tert-butyl-2-[4-[(cyclopropylamino)methyl]-2-fluorophenoxy]acetamide
CID 107687996
2-(2-amino-4-fluorophenoxy)-N-cyclohexylacetamide
CID 55068862
2-(2-bromo-4-propylphenoxy)-N-cycloheptylacetamide
CID 19201484
1-cyclopentyl-3-[2-fluoro-4-(methylaminomethyl)phenoxy]propan-2-ol
CID 107686518
[2-(cyclohexylamino)-2-oxoethyl] 3-fluoro-4-methoxybenzoate
CID 7522935

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-[2-fluoro-4-(methylaminomethyl)phenoxy]acetamide?
The IUPAC name of N-cyclohexyl-2-[2-fluoro-4-(methylaminomethyl)phenoxy]acetamide (CID 107686419) is N-cyclohexyl-2-[2-fluoro-4-(methylaminomethyl)phenoxy]acetamide.
What is the SMILES notation for N-cyclohexyl-2-[2-fluoro-4-(methylaminomethyl)phenoxy]acetamide?
The canonical SMILES for N-cyclohexyl-2-[2-fluoro-4-(methylaminomethyl)phenoxy]acetamide is CNCc1ccc(OCC(=O)NC2CCCCC2)c(F)c1.
What is the InChIKey of N-cyclohexyl-2-[2-fluoro-4-(methylaminomethyl)phenoxy]acetamide?
The InChIKey is QCWGPIDPSDRJME-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23FN2O2/c1-18-10-12-7-8-15(14(17)9-12)21-11-16(20)19-13-5-3-2-4-6-13/h7-9,13,18H,2-6,10-11H2,1H3,(H,19,20).
What are the key properties of N-cyclohexyl-2-[2-fluoro-4-(methylaminomethyl)phenoxy]acetamide?
N-cyclohexyl-2-[2-fluoro-4-(methylaminomethyl)phenoxy]acetamide has a molecular weight of 294.37 g/mol, XLogP of 2.37, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-[2-fluoro-4-(methylaminomethyl)phenoxy]acetamide is sourced from PubChem (CID 107686419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).