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

C19H23FN2O — CID 109024693

IUPAC3-(4-ethylanilino)-N-[2-(2-fluorophenyl)ethyl]propanamide
SMILESCCc1ccc(NCCC(=O)NCCc2ccccc2F)cc1
InChIInChI=1S/C19H23FN2O/c1-2-15-7-9-17(10-8-15)21-14-12-19(23)22-13-11-16-5-3-4-6-18(16)20/h3-10,21H,2,11-14H2,1H3,(H,22,23)
InChIKeyXEMGZGSVACYTQL-UHFFFAOYSA-N
MW314.40 g/mol
LogP3.55
Rot. Bonds8

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

3-(4-ethylanilino)-N-[2-(2-fluorophenyl)ethyl]propanamide (PubChem CID 109024693) has the molecular formula C19H23FN2O and a molecular weight of 314.40 g/mol. Its IUPAC name is 3-(4-ethylanilino)-N-[2-(2-fluorophenyl)ethyl]propanamide.

Molecular Properties

Compound Name3-(4-ethylanilino)-N-[2-(2-fluorophenyl)ethyl]propanamide
PubChem CID109024693
Molecular FormulaC19H23FN2O
Molecular Weight314.40 g/mol
Exact Mass314.18
IUPAC Name3-(4-ethylanilino)-N-[2-(2-fluorophenyl)ethyl]propanamide
SMILESCCc1ccc(NCCC(=O)NCCc2ccccc2F)cc1
InChIInChI=1S/C19H23FN2O/c1-2-15-7-9-17(10-8-15)21-14-12-19(23)22-13-11-16-5-3-4-6-18(16)20/h3-10,21H,2,11-14H2,1H3,(H,22,23)
InChIKeyXEMGZGSVACYTQL-UHFFFAOYSA-N
XLogP3.55
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.40
LogP ≤ 53.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(2-fluorophenyl)ethyl]-3-(4-propan-2-ylanilino)propanamide
CID 109024697
N-(4-ethylphenyl)-N'-[2-(2-fluorophenyl)ethyl]-2,2-dimethylpropanediamide
CID 108964083
[2-[2-(2-fluorophenyl)ethylamino]-2-oxoethyl] 4-ethylbenzoate
CID 9230111
3-(3,4-dichloroanilino)-N-[2-(2-fluorophenyl)ethyl]propanamide
CID 109024765
N-[2-(4-fluorophenyl)ethyl]-3-[2-(2-fluorophenyl)ethylamino]propanamide
CID 109024783
N-[2-(2-fluorophenyl)ethyl]propanamide
CID 22380876
3-N-(4-ethylphenyl)-1-N-[2-(2-fluorophenyl)ethyl]benzene-1,3-dicarboxamide
CID 109055398
2-(2-fluorophenyl)-N-[2-(2-fluorophenyl)ethyl]acetamide
CID 78792118
3-[2-(2-fluorophenyl)ethylamino]-N-(2-methoxyethyl)propanamide
CID 109015003
3-(2,6-diethylanilino)-N-[2-(4-fluorophenyl)ethyl]propanamide
CID 109024995
1-(2-ethylphenyl)-3-[2-(2-fluorophenyl)ethyl]urea
CID 108900106
3-(3-chloro-4-methylphenyl)-N-[2-(2-fluorophenyl)ethyl]propanamide
CID 46679807

Frequently Asked Questions

What is the IUPAC name of 3-(4-ethylanilino)-N-[2-(2-fluorophenyl)ethyl]propanamide?
The IUPAC name of 3-(4-ethylanilino)-N-[2-(2-fluorophenyl)ethyl]propanamide (CID 109024693) is 3-(4-ethylanilino)-N-[2-(2-fluorophenyl)ethyl]propanamide.
What is the SMILES notation for 3-(4-ethylanilino)-N-[2-(2-fluorophenyl)ethyl]propanamide?
The canonical SMILES for 3-(4-ethylanilino)-N-[2-(2-fluorophenyl)ethyl]propanamide is CCc1ccc(NCCC(=O)NCCc2ccccc2F)cc1.
What is the InChIKey of 3-(4-ethylanilino)-N-[2-(2-fluorophenyl)ethyl]propanamide?
The InChIKey is XEMGZGSVACYTQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23FN2O/c1-2-15-7-9-17(10-8-15)21-14-12-19(23)22-13-11-16-5-3-4-6-18(16)20/h3-10,21H,2,11-14H2,1H3,(H,22,23).
What are the key properties of 3-(4-ethylanilino)-N-[2-(2-fluorophenyl)ethyl]propanamide?
3-(4-ethylanilino)-N-[2-(2-fluorophenyl)ethyl]propanamide has a molecular weight of 314.40 g/mol, XLogP of 3.55, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-ethylanilino)-N-[2-(2-fluorophenyl)ethyl]propanamide is sourced from PubChem (CID 109024693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).