N-[4-(4-fluoro-2-methoxyphenyl)-3-pyridinyl]acetamide

C14H13FN2O2 — CID 140628304

IUPACN-[4-(4-fluoro-2-methoxyphenyl)-3-pyridinyl]acetamide
SMILESCOc1cc(F)ccc1-c1ccncc1NC(C)=O
InChIInChI=1S/C14H13FN2O2/c1-9(18)17-13-8-16-6-5-11(13)12-4-3-10(15)7-14(12)19-2/h3-8H,1-2H3,(H,17,18)
InChIKeyLKPYOAUMOIHSIZ-UHFFFAOYSA-N
MW260.27 g/mol
LogP2.85
Rot. Bonds3

About N-[4-(4-fluoro-2-methoxyphenyl)-3-pyridinyl]acetamide

N-[4-(4-fluoro-2-methoxyphenyl)-3-pyridinyl]acetamide (PubChem CID 140628304) has the molecular formula C14H13FN2O2 and a molecular weight of 260.27 g/mol. Its IUPAC name is N-[4-(4-fluoro-2-methoxyphenyl)-3-pyridinyl]acetamide.

Molecular Properties

Compound NameN-[4-(4-fluoro-2-methoxyphenyl)-3-pyridinyl]acetamide
PubChem CID140628304
Molecular FormulaC14H13FN2O2
Molecular Weight260.27 g/mol
Exact Mass260.10
IUPAC NameN-[4-(4-fluoro-2-methoxyphenyl)-3-pyridinyl]acetamide
SMILESCOc1cc(F)ccc1-c1ccncc1NC(C)=O
InChIInChI=1S/C14H13FN2O2/c1-9(18)17-13-8-16-6-5-11(13)12-4-3-10(15)7-14(12)19-2/h3-8H,1-2H3,(H,17,18)
InChIKeyLKPYOAUMOIHSIZ-UHFFFAOYSA-N
XLogP2.85
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.27
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[4-(4-fluoro-2-methoxyphenyl)-3-pyridinyl]acetamide?
The IUPAC name of N-[4-(4-fluoro-2-methoxyphenyl)-3-pyridinyl]acetamide (CID 140628304) is N-[4-(4-fluoro-2-methoxyphenyl)-3-pyridinyl]acetamide.
What is the SMILES notation for N-[4-(4-fluoro-2-methoxyphenyl)-3-pyridinyl]acetamide?
The canonical SMILES for N-[4-(4-fluoro-2-methoxyphenyl)-3-pyridinyl]acetamide is COc1cc(F)ccc1-c1ccncc1NC(C)=O.
What is the InChIKey of N-[4-(4-fluoro-2-methoxyphenyl)-3-pyridinyl]acetamide?
The InChIKey is LKPYOAUMOIHSIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13FN2O2/c1-9(18)17-13-8-16-6-5-11(13)12-4-3-10(15)7-14(12)19-2/h3-8H,1-2H3,(H,17,18).
What are the key properties of N-[4-(4-fluoro-2-methoxyphenyl)-3-pyridinyl]acetamide?
N-[4-(4-fluoro-2-methoxyphenyl)-3-pyridinyl]acetamide has a molecular weight of 260.27 g/mol, XLogP of 2.85, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-fluoro-2-methoxyphenyl)-3-pyridinyl]acetamide is sourced from PubChem (CID 140628304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).