N-tert-butyl-2-[[2-(3-fluorophenoxy)acetyl]amino]acetamide

C14H19FN2O3 — CID 41276805

IUPACN-tert-butyl-2-[[2-(3-fluorophenoxy)acetyl]amino]acetamide
SMILESCC(C)(C)NC(=O)CNC(=O)COc1cccc(F)c1
InChIInChI=1S/C14H19FN2O3/c1-14(2,3)17-12(18)8-16-13(19)9-20-11-6-4-5-10(15)7-11/h4-7H,8-9H2,1-3H3,(H,16,19)(H,17,18)
InChIKeyAEHYYCFHRGOUGS-UHFFFAOYSA-N
MW282.31 g/mol
LogP1.24
Rot. Bonds5

About N-tert-butyl-2-[[2-(3-fluorophenoxy)acetyl]amino]acetamide

N-tert-butyl-2-[[2-(3-fluorophenoxy)acetyl]amino]acetamide (PubChem CID 41276805) has the molecular formula C14H19FN2O3 and a molecular weight of 282.31 g/mol. Its IUPAC name is N-tert-butyl-2-[[2-(3-fluorophenoxy)acetyl]amino]acetamide.

Molecular Properties

Compound NameN-tert-butyl-2-[[2-(3-fluorophenoxy)acetyl]amino]acetamide
PubChem CID41276805
Molecular FormulaC14H19FN2O3
Molecular Weight282.31 g/mol
Exact Mass282.14
IUPAC NameN-tert-butyl-2-[[2-(3-fluorophenoxy)acetyl]amino]acetamide
SMILESCC(C)(C)NC(=O)CNC(=O)COc1cccc(F)c1
InChIInChI=1S/C14H19FN2O3/c1-14(2,3)17-12(18)8-16-13(19)9-20-11-6-4-5-10(15)7-11/h4-7H,8-9H2,1-3H3,(H,16,19)(H,17,18)
InChIKeyAEHYYCFHRGOUGS-UHFFFAOYSA-N
XLogP1.24
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.31
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-bromoprop-2-enyl)-2-(3-fluorophenoxy)acetamide
CID 115594649
2-(3-fluorophenoxy)-N-prop-2-ynylacetamide
CID 9008020
2-(3-fluorophenoxy)-N-pentylacetamide
CID 110756252
2-(3-fluorophenoxy)-N-(3-methoxypropyl)acetamide
CID 60626010
2-(3-fluorophenoxy)-N-propan-2-ylacetamide
CID 60626005
N-tert-butyl-2-[[2-[4-(4-methylphenoxy)phenoxy]acetyl]amino]acetamide
CID 24633483
2-[[2-(3-fluorophenoxy)acetyl]amino]-3,3-dimethylbutanoic acid
CID 43467655
N-[(4-ethoxyphenyl)methyl]-2-(3-fluorophenoxy)acetamide
CID 110780897
5-[[2-(3-fluorophenoxy)acetyl]amino]pentanoic acid
CID 62032120
N-(3-fluorophenyl)-2-[[2-(4-methoxyphenoxy)acetyl]amino]acetamide
CID 49335848
2-(3-fluorophenoxy)-N-phenylacetamide
CID 2709732
2-[3-[2-(tert-butylamino)-2-oxoethoxy]phenyl]acetic acid
CID 61398227

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-[[2-(3-fluorophenoxy)acetyl]amino]acetamide?
The IUPAC name of N-tert-butyl-2-[[2-(3-fluorophenoxy)acetyl]amino]acetamide (CID 41276805) is N-tert-butyl-2-[[2-(3-fluorophenoxy)acetyl]amino]acetamide.
What is the SMILES notation for N-tert-butyl-2-[[2-(3-fluorophenoxy)acetyl]amino]acetamide?
The canonical SMILES for N-tert-butyl-2-[[2-(3-fluorophenoxy)acetyl]amino]acetamide is CC(C)(C)NC(=O)CNC(=O)COc1cccc(F)c1.
What is the InChIKey of N-tert-butyl-2-[[2-(3-fluorophenoxy)acetyl]amino]acetamide?
The InChIKey is AEHYYCFHRGOUGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN2O3/c1-14(2,3)17-12(18)8-16-13(19)9-20-11-6-4-5-10(15)7-11/h4-7H,8-9H2,1-3H3,(H,16,19)(H,17,18).
What are the key properties of N-tert-butyl-2-[[2-(3-fluorophenoxy)acetyl]amino]acetamide?
N-tert-butyl-2-[[2-(3-fluorophenoxy)acetyl]amino]acetamide has a molecular weight of 282.31 g/mol, XLogP of 1.24, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-[[2-(3-fluorophenoxy)acetyl]amino]acetamide is sourced from PubChem (CID 41276805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).