3-(4-fluorophenyl)-N-[2-(4-methoxyphenyl)ethyl]propanamide

C18H20FNO2 — CID 18107472

IUPAC3-(4-fluorophenyl)-N-[2-(4-methoxyphenyl)ethyl]propanamide
SMILESCOc1ccc(CCNC(=O)CCc2ccc(F)cc2)cc1
InChIInChI=1S/C18H20FNO2/c1-22-17-9-4-15(5-10-17)12-13-20-18(21)11-6-14-2-7-16(19)8-3-14/h2-5,7-10H,6,11-13H2,1H3,(H,20,21)
InChIKeyKSKMFCQDPGQKGG-UHFFFAOYSA-N
MW301.36 g/mol
LogP3.13
Rot. Bonds7

About 3-(4-fluorophenyl)-N-[2-(4-methoxyphenyl)ethyl]propanamide

3-(4-fluorophenyl)-N-[2-(4-methoxyphenyl)ethyl]propanamide (PubChem CID 18107472) has the molecular formula C18H20FNO2 and a molecular weight of 301.36 g/mol. Its IUPAC name is 3-(4-fluorophenyl)-N-[2-(4-methoxyphenyl)ethyl]propanamide.

Molecular Properties

Compound Name3-(4-fluorophenyl)-N-[2-(4-methoxyphenyl)ethyl]propanamide
PubChem CID18107472
Molecular FormulaC18H20FNO2
Molecular Weight301.36 g/mol
Exact Mass301.15
IUPAC Name3-(4-fluorophenyl)-N-[2-(4-methoxyphenyl)ethyl]propanamide
SMILESCOc1ccc(CCNC(=O)CCc2ccc(F)cc2)cc1
InChIInChI=1S/C18H20FNO2/c1-22-17-9-4-15(5-10-17)12-13-20-18(21)11-6-14-2-7-16(19)8-3-14/h2-5,7-10H,6,11-13H2,1H3,(H,20,21)
InChIKeyKSKMFCQDPGQKGG-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

4-(4-fluorophenyl)-N-[2-(4-methoxyphenyl)ethyl]butanamide
CID 110297665
N-[2-(4-fluorophenyl)ethyl]-5-(4-methoxyphenyl)pentanamide
CID 110297832
N-[2-(4-fluorophenyl)ethyl]-3-[(4-methoxyphenyl)methylamino]propanamide
CID 109022421
N-[2-(4-fluorophenyl)ethyl]-N'-(4-methoxyphenyl)propanediamide
CID 108948446
3-(4-ethylphenyl)-N-[2-(4-fluorophenyl)ethyl]propanamide
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3-(4-methoxyphenyl)-N-[8-[3-(4-methoxyphenyl)propanoylamino]octyl]propanamide
CID 4661025
N-[2-[4-(dimethylamino)phenyl]ethyl]-3-(4-methoxyphenyl)propanamide
CID 16889384
4-fluoro-N-[2-[2-(4-methoxyphenyl)ethylamino]-2-oxoethyl]benzamide
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3-(4-fluorophenyl)-N-(2-methoxyethyl)propanamide
CID 70870353
2-[4-[2-[3-(4-methoxyphenyl)propanoylamino]ethyl]phenoxy]acetic acid
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N-[2-(4-fluorophenyl)ethyl]-3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]propanamide
CID 51310068
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CID 108538633

Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenyl)-N-[2-(4-methoxyphenyl)ethyl]propanamide?
The IUPAC name of 3-(4-fluorophenyl)-N-[2-(4-methoxyphenyl)ethyl]propanamide (CID 18107472) is 3-(4-fluorophenyl)-N-[2-(4-methoxyphenyl)ethyl]propanamide.
What is the SMILES notation for 3-(4-fluorophenyl)-N-[2-(4-methoxyphenyl)ethyl]propanamide?
The canonical SMILES for 3-(4-fluorophenyl)-N-[2-(4-methoxyphenyl)ethyl]propanamide is COc1ccc(CCNC(=O)CCc2ccc(F)cc2)cc1.
What is the InChIKey of 3-(4-fluorophenyl)-N-[2-(4-methoxyphenyl)ethyl]propanamide?
The InChIKey is KSKMFCQDPGQKGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20FNO2/c1-22-17-9-4-15(5-10-17)12-13-20-18(21)11-6-14-2-7-16(19)8-3-14/h2-5,7-10H,6,11-13H2,1H3,(H,20,21).
What are the key properties of 3-(4-fluorophenyl)-N-[2-(4-methoxyphenyl)ethyl]propanamide?
3-(4-fluorophenyl)-N-[2-(4-methoxyphenyl)ethyl]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 3-(4-fluorophenyl)-N-[2-(4-methoxyphenyl)ethyl]propanamide is sourced from PubChem (CID 18107472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).