N-[2-(3-fluorophenyl)ethyl]-3-(2-methoxyphenyl)propanamide

C18H20FNO2 — CID 18118760

IUPACN-[2-(3-fluorophenyl)ethyl]-3-(2-methoxyphenyl)propanamide
SMILESCOc1ccccc1CCC(=O)NCCc1cccc(F)c1
InChIInChI=1S/C18H20FNO2/c1-22-17-8-3-2-6-15(17)9-10-18(21)20-12-11-14-5-4-7-16(19)13-14/h2-8,13H,9-12H2,1H3,(H,20,21)
InChIKeyRDKLMUVKBHPINO-UHFFFAOYSA-N
MW301.36 g/mol
LogP3.13
Rot. Bonds7

About N-[2-(3-fluorophenyl)ethyl]-3-(2-methoxyphenyl)propanamide

N-[2-(3-fluorophenyl)ethyl]-3-(2-methoxyphenyl)propanamide (PubChem CID 18118760) has the molecular formula C18H20FNO2 and a molecular weight of 301.36 g/mol. Its IUPAC name is N-[2-(3-fluorophenyl)ethyl]-3-(2-methoxyphenyl)propanamide.

Molecular Properties

Compound NameN-[2-(3-fluorophenyl)ethyl]-3-(2-methoxyphenyl)propanamide
PubChem CID18118760
Molecular FormulaC18H20FNO2
Molecular Weight301.36 g/mol
Exact Mass301.15
IUPAC NameN-[2-(3-fluorophenyl)ethyl]-3-(2-methoxyphenyl)propanamide
SMILESCOc1ccccc1CCC(=O)NCCc1cccc(F)c1
InChIInChI=1S/C18H20FNO2/c1-22-17-8-3-2-6-15(17)9-10-18(21)20-12-11-14-5-4-7-16(19)13-14/h2-8,13H,9-12H2,1H3,(H,20,21)
InChIKeyRDKLMUVKBHPINO-UHFFFAOYSA-N
XLogP3.13
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.36
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2,3-dimethoxyphenyl)-N-[2-(3-fluorophenyl)ethyl]propanamide
CID 18118791
2-(5-fluoro-2-methoxyphenyl)-N-(2-phenylethyl)acetamide
CID 110767149
5-fluoro-N-[2-(3-fluorophenyl)ethyl]-2-methoxybenzamide
CID 31116362
1-fluoro-3-propylbenzene;1-methoxy-2-propylbenzene
CID 142218123
N-[2-(3-fluorophenyl)ethyl]-2-(2-hydroxyphenoxy)acetamide
CID 78812799
3-(2-methoxyphenyl)-N-[2-(2-methyl-1,3-benzoxazol-5-yl)ethyl]propanamide
CID 110707517
N-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]-3-(2-methoxyphenyl)propanamide
CID 110792398
N-[(2-fluorophenyl)methyl]-3-(2-methoxyphenyl)propanamide
CID 40600143
N-(4-hydroxybutyl)-3-(2-methoxyphenyl)propanamide
CID 106843312
N-[2-(2-methoxyphenoxy)ethyl]-3-(2-methoxyphenyl)propanamide
CID 51157212
N'-[2-(4-fluorophenyl)acetyl]-3-(2-methoxyphenyl)propanehydrazide
CID 40730249
3-(3-bromophenyl)-N-[2-(3-fluorophenyl)ethyl]propanamide
CID 127122417

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-fluorophenyl)ethyl]-3-(2-methoxyphenyl)propanamide?
The IUPAC name of N-[2-(3-fluorophenyl)ethyl]-3-(2-methoxyphenyl)propanamide (CID 18118760) is N-[2-(3-fluorophenyl)ethyl]-3-(2-methoxyphenyl)propanamide.
What is the SMILES notation for N-[2-(3-fluorophenyl)ethyl]-3-(2-methoxyphenyl)propanamide?
The canonical SMILES for N-[2-(3-fluorophenyl)ethyl]-3-(2-methoxyphenyl)propanamide is COc1ccccc1CCC(=O)NCCc1cccc(F)c1.
What is the InChIKey of N-[2-(3-fluorophenyl)ethyl]-3-(2-methoxyphenyl)propanamide?
The InChIKey is RDKLMUVKBHPINO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20FNO2/c1-22-17-8-3-2-6-15(17)9-10-18(21)20-12-11-14-5-4-7-16(19)13-14/h2-8,13H,9-12H2,1H3,(H,20,21).
What are the key properties of N-[2-(3-fluorophenyl)ethyl]-3-(2-methoxyphenyl)propanamide?
N-[2-(3-fluorophenyl)ethyl]-3-(2-methoxyphenyl)propanamide has a molecular weight of 301.36 g/mol, XLogP of 3.13, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-fluorophenyl)ethyl]-3-(2-methoxyphenyl)propanamide is sourced from PubChem (CID 18118760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).