2-(3,5-diethylpyrazol-1-yl)-N-methyl-2-phenylethanamine

C16H23N3 — CID 82694866

IUPAC2-(3,5-diethylpyrazol-1-yl)-N-methyl-2-phenylethanamine
SMILESCCc1cc(CC)n(C(CNC)c2ccccc2)n1
InChIInChI=1S/C16H23N3/c1-4-14-11-15(5-2)19(18-14)16(12-17-3)13-9-7-6-8-10-13/h6-11,16-17H,4-5,12H2,1-3H3
InChIKeyIIUJHRXQZVPKPU-UHFFFAOYSA-N
MW257.38 g/mol
LogP2.82
Rot. Bonds6

About 2-(3,5-diethylpyrazol-1-yl)-N-methyl-2-phenylethanamine

2-(3,5-diethylpyrazol-1-yl)-N-methyl-2-phenylethanamine (PubChem CID 82694866) has the molecular formula C16H23N3 and a molecular weight of 257.38 g/mol. Its IUPAC name is 2-(3,5-diethylpyrazol-1-yl)-N-methyl-2-phenylethanamine.

Molecular Properties

Compound Name2-(3,5-diethylpyrazol-1-yl)-N-methyl-2-phenylethanamine
PubChem CID82694866
Molecular FormulaC16H23N3
Molecular Weight257.38 g/mol
Exact Mass257.19
IUPAC Name2-(3,5-diethylpyrazol-1-yl)-N-methyl-2-phenylethanamine
SMILESCCc1cc(CC)n(C(CNC)c2ccccc2)n1
InChIInChI=1S/C16H23N3/c1-4-14-11-15(5-2)19(18-14)16(12-17-3)13-9-7-6-8-10-13/h6-11,16-17H,4-5,12H2,1-3H3
InChIKeyIIUJHRXQZVPKPU-UHFFFAOYSA-N
XLogP2.82
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.38
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(3,5-diethylpyrazol-1-yl)-N-methyl-2-phenylethanamine 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-(3,5-diethylpyrazol-1-yl)-N-methylpentan-1-amine
CID 83044068
2-(3,5-diethylpyrazol-1-yl)-2-(3-methoxyphenyl)ethanamine
CID 82693670
2-(2-ethylimidazol-1-yl)-N-methyl-2-phenylethanamine
CID 62443341
N-methyl-2-(2-methylbenzimidazol-1-yl)-2-phenylethanamine
CID 62563009
2-(3-chlorophenyl)-3-(3-ethyl-1-methylpyrazol-5-yl)-N-methylpropan-1-amine
CID 79443035
1-(3,5-diethylpyrazol-1-yl)-1-(3-fluorophenyl)propan-2-amine
CID 82692322
(2R)-2-(3,5-diethylpyrazol-1-yl)propanoic acid
CID 107427777
3-(3,5-diethylpyrazol-1-yl)-2-phenylpropanoic acid
CID 82692790
3-(3,5-diethylpyrazol-1-yl)-N-ethylbutan-1-amine
CID 82694867
N-methyl-2-phenyl-2-(5-phenyltetrazol-2-yl)ethanamine
CID 62448473
1-[3-(3,5-diethylpyrazol-1-yl)phenyl]-N-ethylethanamine
CID 82694896
1-(2-chlorophenyl)-1-(3,5-diethylpyrazol-1-yl)propan-2-amine
CID 82692543

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-diethylpyrazol-1-yl)-N-methyl-2-phenylethanamine?
The IUPAC name of 2-(3,5-diethylpyrazol-1-yl)-N-methyl-2-phenylethanamine (CID 82694866) is 2-(3,5-diethylpyrazol-1-yl)-N-methyl-2-phenylethanamine.
What is the SMILES notation for 2-(3,5-diethylpyrazol-1-yl)-N-methyl-2-phenylethanamine?
The canonical SMILES for 2-(3,5-diethylpyrazol-1-yl)-N-methyl-2-phenylethanamine is CCc1cc(CC)n(C(CNC)c2ccccc2)n1.
What is the InChIKey of 2-(3,5-diethylpyrazol-1-yl)-N-methyl-2-phenylethanamine?
The InChIKey is IIUJHRXQZVPKPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3/c1-4-14-11-15(5-2)19(18-14)16(12-17-3)13-9-7-6-8-10-13/h6-11,16-17H,4-5,12H2,1-3H3.
What are the key properties of 2-(3,5-diethylpyrazol-1-yl)-N-methyl-2-phenylethanamine?
2-(3,5-diethylpyrazol-1-yl)-N-methyl-2-phenylethanamine has a molecular weight of 257.38 g/mol, XLogP of 2.82, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-diethylpyrazol-1-yl)-N-methyl-2-phenylethanamine is sourced from PubChem (CID 82694866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).