2-(3,5-diethyl-1-methylpyrazol-4-yl)-N-[1-(5-fluoro-2-methoxyphenyl)ethyl]acetamide

C19H26FN3O2 — CID 86819469

IUPAC2-(3,5-diethyl-1-methylpyrazol-4-yl)-N-[1-(5-fluoro-2-methoxyphenyl)ethyl]acetamide
SMILESCCc1nn(C)c(CC)c1CC(=O)NC(C)c1cc(F)ccc1OC
InChIInChI=1S/C19H26FN3O2/c1-6-16-15(17(7-2)23(4)22-16)11-19(24)21-12(3)14-10-13(20)8-9-18(14)25-5/h8-10,12H,6-7,11H2,1-5H3,(H,21,24)
InChIKeyJNMWQNLJHUTFJU-UHFFFAOYSA-N
MW347.43 g/mol
LogP3.11
Rot. Bonds7

About 2-(3,5-diethyl-1-methylpyrazol-4-yl)-N-[1-(5-fluoro-2-methoxyphenyl)ethyl]acetamide

2-(3,5-diethyl-1-methylpyrazol-4-yl)-N-[1-(5-fluoro-2-methoxyphenyl)ethyl]acetamide (PubChem CID 86819469) has the molecular formula C19H26FN3O2 and a molecular weight of 347.43 g/mol. Its IUPAC name is 2-(3,5-diethyl-1-methylpyrazol-4-yl)-N-[1-(5-fluoro-2-methoxyphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(3,5-diethyl-1-methylpyrazol-4-yl)-N-[1-(5-fluoro-2-methoxyphenyl)ethyl]acetamide
PubChem CID86819469
Molecular FormulaC19H26FN3O2
Molecular Weight347.43 g/mol
Exact Mass347.20
IUPAC Name2-(3,5-diethyl-1-methylpyrazol-4-yl)-N-[1-(5-fluoro-2-methoxyphenyl)ethyl]acetamide
SMILESCCc1nn(C)c(CC)c1CC(=O)NC(C)c1cc(F)ccc1OC
InChIInChI=1S/C19H26FN3O2/c1-6-16-15(17(7-2)23(4)22-16)11-19(24)21-12(3)14-10-13(20)8-9-18(14)25-5/h8-10,12H,6-7,11H2,1-5H3,(H,21,24)
InChIKeyJNMWQNLJHUTFJU-UHFFFAOYSA-N
XLogP3.11
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.43
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(3,5-diethyl-1-methylpyrazol-4-yl)-N-[1-(5-fluoro-2-methoxyphenyl)ethyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-chloro-N-[1-(5-fluoro-2-methoxyphenyl)ethyl]acetamide
CID 43701037
N-[1-(2-methoxy-5-methylphenyl)ethyl]-2-(1,3,5-trimethylpyrazol-4-yl)acetamide
CID 51295317
2-[1-(4-fluorophenyl)-3,5-dimethylpyrazol-4-yl]-N-[(1S)-1-(2-methoxy-5-methylphenyl)ethyl]acetamide
CID 51955758
N-[(1S)-1-(2-methoxyphenyl)ethyl]-2-(1,3,5-trimethylpyrazol-4-yl)acetamide
CID 33077344
N-[(1S)-1-(2,5-dimethoxyphenyl)ethyl]-2-(4-ethylphenyl)acetamide
CID 100562771
N-[(1S)-1-(2,5-dimethoxyphenyl)ethyl]-2-(3-methyl-4-oxophthalazin-1-yl)acetamide
CID 26442487
N-(5-chloro-2-fluorophenyl)-2-(3,5-diethyl-1-methylpyrazol-4-yl)acetamide
CID 122145361
3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[1-(5-fluoro-2-methoxyphenyl)ethyl]propanamide
CID 75461361
N-[1-(2,4-difluorophenyl)ethyl]-2-(2,5-dimethoxyphenyl)acetamide
CID 78806064
2-(1-aminocyclobutyl)-N-[1-(5-fluoro-2-methoxyphenyl)ethyl]acetamide
CID 79853728
(2R)-2-amino-N-[1-(5-fluoro-2-methoxyphenyl)ethyl]propanamide;hydrochloride
CID 119292617
2-bromo-N-[1-(5-fluoro-2-methoxyphenyl)ethyl]-3-methylbutanamide
CID 43701042

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-diethyl-1-methylpyrazol-4-yl)-N-[1-(5-fluoro-2-methoxyphenyl)ethyl]acetamide?
The IUPAC name of 2-(3,5-diethyl-1-methylpyrazol-4-yl)-N-[1-(5-fluoro-2-methoxyphenyl)ethyl]acetamide (CID 86819469) is 2-(3,5-diethyl-1-methylpyrazol-4-yl)-N-[1-(5-fluoro-2-methoxyphenyl)ethyl]acetamide.
What is the SMILES notation for 2-(3,5-diethyl-1-methylpyrazol-4-yl)-N-[1-(5-fluoro-2-methoxyphenyl)ethyl]acetamide?
The canonical SMILES for 2-(3,5-diethyl-1-methylpyrazol-4-yl)-N-[1-(5-fluoro-2-methoxyphenyl)ethyl]acetamide is CCc1nn(C)c(CC)c1CC(=O)NC(C)c1cc(F)ccc1OC.
What is the InChIKey of 2-(3,5-diethyl-1-methylpyrazol-4-yl)-N-[1-(5-fluoro-2-methoxyphenyl)ethyl]acetamide?
The InChIKey is JNMWQNLJHUTFJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26FN3O2/c1-6-16-15(17(7-2)23(4)22-16)11-19(24)21-12(3)14-10-13(20)8-9-18(14)25-5/h8-10,12H,6-7,11H2,1-5H3,(H,21,24).
What are the key properties of 2-(3,5-diethyl-1-methylpyrazol-4-yl)-N-[1-(5-fluoro-2-methoxyphenyl)ethyl]acetamide?
2-(3,5-diethyl-1-methylpyrazol-4-yl)-N-[1-(5-fluoro-2-methoxyphenyl)ethyl]acetamide has a molecular weight of 347.43 g/mol, XLogP of 3.11, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-diethyl-1-methylpyrazol-4-yl)-N-[1-(5-fluoro-2-methoxyphenyl)ethyl]acetamide is sourced from PubChem (CID 86819469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).