N-[2-(2-fluoro-5-methoxyphenyl)ethyl]acetamide

C11H14FNO2 — CID 86035442

IUPACN-[2-(2-fluoro-5-methoxyphenyl)ethyl]acetamide
SMILESCOc1ccc(F)c(CCNC(C)=O)c1
InChIInChI=1S/C11H14FNO2/c1-8(14)13-6-5-9-7-10(15-2)3-4-11(9)12/h3-4,7H,5-6H2,1-2H3,(H,13,14)
InChIKeyIEVRPXASYUZCBU-UHFFFAOYSA-N
MW211.24 g/mol
LogP1.51
Rot. Bonds4

About N-[2-(2-fluoro-5-methoxyphenyl)ethyl]acetamide

N-[2-(2-fluoro-5-methoxyphenyl)ethyl]acetamide (PubChem CID 86035442) has the molecular formula C11H14FNO2 and a molecular weight of 211.24 g/mol. Its IUPAC name is N-[2-(2-fluoro-5-methoxyphenyl)ethyl]acetamide.

Molecular Properties

Compound NameN-[2-(2-fluoro-5-methoxyphenyl)ethyl]acetamide
PubChem CID86035442
Molecular FormulaC11H14FNO2
Molecular Weight211.24 g/mol
Exact Mass211.10
IUPAC NameN-[2-(2-fluoro-5-methoxyphenyl)ethyl]acetamide
SMILESCOc1ccc(F)c(CCNC(C)=O)c1
InChIInChI=1S/C11H14FNO2/c1-8(14)13-6-5-9-7-10(15-2)3-4-11(9)12/h3-4,7H,5-6H2,1-2H3,(H,13,14)
InChIKeyIEVRPXASYUZCBU-UHFFFAOYSA-N
XLogP1.51
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.24
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(2-bromo-5-methoxyphenyl)ethyl]acetamide
CID 12626088
N-[2-(2-fluoro-7-methoxynaphthalen-1-yl)ethyl]acetamide
CID 162686350
3-(2-fluoro-5-methoxyphenyl)propanoic acid
CID 83402634
N-[2-(2,5-difluorophenyl)ethyl]-4-methoxybenzamide
CID 110788169
N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide
CID 139057200
N-[2-[5-(2-chloroacetyl)-2-fluorophenyl]ethyl]acetamide
CID 71755478
methanol;N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide
CID 174597749
(2-(18F)fluoro-5-methoxyphenyl)methyl acetate
CID 156599512
N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide;sulfuric acid
CID 71529133
N-[2-(3-bromo-7-methoxynaphthalen-1-yl)ethyl]acetamide
CID 12985488
N-(2-acetamidoethyl)-3-(2,5-dimethoxyphenyl)propanamide
CID 38004607
N-[3-(2-fluoro-5-methoxyphenyl)-2,3-dihydroxypropyl]acetamide
CID 170829935

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-fluoro-5-methoxyphenyl)ethyl]acetamide?
The IUPAC name of N-[2-(2-fluoro-5-methoxyphenyl)ethyl]acetamide (CID 86035442) is N-[2-(2-fluoro-5-methoxyphenyl)ethyl]acetamide.
What is the SMILES notation for N-[2-(2-fluoro-5-methoxyphenyl)ethyl]acetamide?
The canonical SMILES for N-[2-(2-fluoro-5-methoxyphenyl)ethyl]acetamide is COc1ccc(F)c(CCNC(C)=O)c1.
What is the InChIKey of N-[2-(2-fluoro-5-methoxyphenyl)ethyl]acetamide?
The InChIKey is IEVRPXASYUZCBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FNO2/c1-8(14)13-6-5-9-7-10(15-2)3-4-11(9)12/h3-4,7H,5-6H2,1-2H3,(H,13,14).
What are the key properties of N-[2-(2-fluoro-5-methoxyphenyl)ethyl]acetamide?
N-[2-(2-fluoro-5-methoxyphenyl)ethyl]acetamide has a molecular weight of 211.24 g/mol, XLogP of 1.51, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-fluoro-5-methoxyphenyl)ethyl]acetamide is sourced from PubChem (CID 86035442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).