N-(3-fluorophenyl)-2-[1-(methylamino)propan-2-yloxy]acetamide

C12H17FN2O2 — CID 62336077

IUPACN-(3-fluorophenyl)-2-[1-(methylamino)propan-2-yloxy]acetamide
SMILESCNCC(C)OCC(=O)Nc1cccc(F)c1
InChIInChI=1S/C12H17FN2O2/c1-9(7-14-2)17-8-12(16)15-11-5-3-4-10(13)6-11/h3-6,9,14H,7-8H2,1-2H3,(H,15,16)
InChIKeyCZNDQXUFVUXLAX-UHFFFAOYSA-N
MW240.28 g/mol
LogP1.39
Rot. Bonds6

About N-(3-fluorophenyl)-2-[1-(methylamino)propan-2-yloxy]acetamide

N-(3-fluorophenyl)-2-[1-(methylamino)propan-2-yloxy]acetamide (PubChem CID 62336077) has the molecular formula C12H17FN2O2 and a molecular weight of 240.28 g/mol. Its IUPAC name is N-(3-fluorophenyl)-2-[1-(methylamino)propan-2-yloxy]acetamide.

Molecular Properties

Compound NameN-(3-fluorophenyl)-2-[1-(methylamino)propan-2-yloxy]acetamide
PubChem CID62336077
Molecular FormulaC12H17FN2O2
Molecular Weight240.28 g/mol
Exact Mass240.13
IUPAC NameN-(3-fluorophenyl)-2-[1-(methylamino)propan-2-yloxy]acetamide
SMILESCNCC(C)OCC(=O)Nc1cccc(F)c1
InChIInChI=1S/C12H17FN2O2/c1-9(7-14-2)17-8-12(16)15-11-5-3-4-10(13)6-11/h3-6,9,14H,7-8H2,1-2H3,(H,15,16)
InChIKeyCZNDQXUFVUXLAX-UHFFFAOYSA-N
XLogP1.39
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.28
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(3-fluoroanilino)-2-oxoethyl] (2S)-2-(phenylcarbamoylamino)propanoate
CID 8887341
N-(3-fluorophenyl)-2-(2-methylbutylamino)acetamide
CID 55108758
[2-(3-fluoroanilino)-2-oxoethyl] but-2-enoate
CID 5254570
2-(2,6-dimethoxyphenoxy)-N-(3-fluorophenyl)acetamide
CID 7612567
2-chloro-N-(3-fluorophenyl)acetamide
CID 2388931
[2-(3-fluoroanilino)-2-oxoethyl] 2,6-difluorobenzoate
CID 2515125
[(2S)-1-amino-1-oxopropan-2-yl]-[2-(3-fluoroanilino)-2-oxoethyl]-methylazanium
CID 9223811
[(1S)-1-cyanoethyl]-[2-(3-fluoroanilino)-2-oxoethyl]-methylazanium
CID 9223815
[2-(3-fluoroanilino)-2-oxoethyl] (2S)-3-methyl-2-(phenylcarbamoylamino)butanoate
CID 7616777
2-methylpropyl N-(3-fluorophenyl)carbamate
CID 15908281
2-[(3,3-difluoro-2-hydroxypropyl)amino]-N-(3-fluorophenyl)acetamide
CID 114093423
(2R)-2-amino-N-[2-(3-fluoroanilino)-2-oxoethyl]propanamide
CID 119308751

Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-2-[1-(methylamino)propan-2-yloxy]acetamide?
The IUPAC name of N-(3-fluorophenyl)-2-[1-(methylamino)propan-2-yloxy]acetamide (CID 62336077) is N-(3-fluorophenyl)-2-[1-(methylamino)propan-2-yloxy]acetamide.
What is the SMILES notation for N-(3-fluorophenyl)-2-[1-(methylamino)propan-2-yloxy]acetamide?
The canonical SMILES for N-(3-fluorophenyl)-2-[1-(methylamino)propan-2-yloxy]acetamide is CNCC(C)OCC(=O)Nc1cccc(F)c1.
What is the InChIKey of N-(3-fluorophenyl)-2-[1-(methylamino)propan-2-yloxy]acetamide?
The InChIKey is CZNDQXUFVUXLAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17FN2O2/c1-9(7-14-2)17-8-12(16)15-11-5-3-4-10(13)6-11/h3-6,9,14H,7-8H2,1-2H3,(H,15,16).
What are the key properties of N-(3-fluorophenyl)-2-[1-(methylamino)propan-2-yloxy]acetamide?
N-(3-fluorophenyl)-2-[1-(methylamino)propan-2-yloxy]acetamide has a molecular weight of 240.28 g/mol, XLogP of 1.39, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorophenyl)-2-[1-(methylamino)propan-2-yloxy]acetamide is sourced from PubChem (CID 62336077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).