2-(3-fluorophenoxy)-N-methyl-N-(1-pyridin-2-ylethyl)propanamide

C17H19FN2O2 — CID 86857457

IUPAC2-(3-fluorophenoxy)-N-methyl-N-(1-pyridin-2-ylethyl)propanamide
SMILESCC(Oc1cccc(F)c1)C(=O)N(C)C(C)c1ccccn1
InChIInChI=1S/C17H19FN2O2/c1-12(16-9-4-5-10-19-16)20(3)17(21)13(2)22-15-8-6-7-14(18)11-15/h4-13H,1-3H3
InChIKeyRDRLFHBGXNFISC-UHFFFAOYSA-N
MW302.35 g/mol
LogP3.21
Rot. Bonds5

About 2-(3-fluorophenoxy)-N-methyl-N-(1-pyridin-2-ylethyl)propanamide

2-(3-fluorophenoxy)-N-methyl-N-(1-pyridin-2-ylethyl)propanamide (PubChem CID 86857457) has the molecular formula C17H19FN2O2 and a molecular weight of 302.35 g/mol. Its IUPAC name is 2-(3-fluorophenoxy)-N-methyl-N-(1-pyridin-2-ylethyl)propanamide.

Molecular Properties

Compound Name2-(3-fluorophenoxy)-N-methyl-N-(1-pyridin-2-ylethyl)propanamide
PubChem CID86857457
Molecular FormulaC17H19FN2O2
Molecular Weight302.35 g/mol
Exact Mass302.14
IUPAC Name2-(3-fluorophenoxy)-N-methyl-N-(1-pyridin-2-ylethyl)propanamide
SMILESCC(Oc1cccc(F)c1)C(=O)N(C)C(C)c1ccccn1
InChIInChI=1S/C17H19FN2O2/c1-12(16-9-4-5-10-19-16)20(3)17(21)13(2)22-15-8-6-7-14(18)11-15/h4-13H,1-3H3
InChIKeyRDRLFHBGXNFISC-UHFFFAOYSA-N
XLogP3.21
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.35
LogP ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(3-fluorophenoxy)propanoyl-methylamino]propanoic acid
CID 62626189
(2R)-2-amino-N-methyl-N-[(1S)-1-pyridin-2-ylethyl]propanamide
CID 124590926
N,2-dimethyl-N-(1-pyridin-2-ylethyl)propanamide
CID 163258537
5-[(3-ethoxyphenoxy)methyl]-N-methyl-N-(1-pyridin-2-ylethyl)-1,2-oxazole-3-carboxamide
CID 71737702
2-(3-fluorophenoxy)propanoyl chloride
CID 139218096
4-[2-(3-fluorophenoxy)propanoyl-methylamino]butanoic acid
CID 43360056
N-ethyl-2-(3-fluorophenoxy)-N-[1-(3-methoxyphenyl)ethyl]propanamide
CID 78853259
2-amino-N-methyl-N-[(1S)-1-pyridin-2-ylethyl]acetamide
CID 96555130
3-[(2S)-1-(3-methoxyphenyl)propan-2-yl]-1-methyl-1-[(1R)-1-pyridin-2-ylethyl]urea
CID 96532415
1-methyl-3-[[3-(phenoxymethyl)phenyl]methyl]-1-(1-pyridin-2-ylethyl)urea
CID 86861427
2-(3-fluorophenoxy)-N-phenyl-N-prop-2-enylpropanamide
CID 78852544
2-[3-(3-fluorophenyl)phenoxy]propanoic acid
CID 82044897

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenoxy)-N-methyl-N-(1-pyridin-2-ylethyl)propanamide?
The IUPAC name of 2-(3-fluorophenoxy)-N-methyl-N-(1-pyridin-2-ylethyl)propanamide (CID 86857457) is 2-(3-fluorophenoxy)-N-methyl-N-(1-pyridin-2-ylethyl)propanamide.
What is the SMILES notation for 2-(3-fluorophenoxy)-N-methyl-N-(1-pyridin-2-ylethyl)propanamide?
The canonical SMILES for 2-(3-fluorophenoxy)-N-methyl-N-(1-pyridin-2-ylethyl)propanamide is CC(Oc1cccc(F)c1)C(=O)N(C)C(C)c1ccccn1.
What is the InChIKey of 2-(3-fluorophenoxy)-N-methyl-N-(1-pyridin-2-ylethyl)propanamide?
The InChIKey is RDRLFHBGXNFISC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN2O2/c1-12(16-9-4-5-10-19-16)20(3)17(21)13(2)22-15-8-6-7-14(18)11-15/h4-13H,1-3H3.
What are the key properties of 2-(3-fluorophenoxy)-N-methyl-N-(1-pyridin-2-ylethyl)propanamide?
2-(3-fluorophenoxy)-N-methyl-N-(1-pyridin-2-ylethyl)propanamide has a molecular weight of 302.35 g/mol, XLogP of 3.21, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenoxy)-N-methyl-N-(1-pyridin-2-ylethyl)propanamide is sourced from PubChem (CID 86857457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).