5-N-[2-(2-methoxyphenyl)ethyl]-1-methyl-3-propylpyrazole-4,5-diamine

C16H24N4O — CID 106259807

IUPAC5-N-[2-(2-methoxyphenyl)ethyl]-1-methyl-3-propylpyrazole-4,5-diamine
SMILESCCCc1nn(C)c(NCCc2ccccc2OC)c1N
InChIInChI=1S/C16H24N4O/c1-4-7-13-15(17)16(20(2)19-13)18-11-10-12-8-5-6-9-14(12)21-3/h5-6,8-9,18H,4,7,10-11,17H2,1-3H3
InChIKeyWEGGDDQZRJONTE-UHFFFAOYSA-N
MW288.39 g/mol
LogP2.62
Rot. Bonds7

About 5-N-[2-(2-methoxyphenyl)ethyl]-1-methyl-3-propylpyrazole-4,5-diamine

5-N-[2-(2-methoxyphenyl)ethyl]-1-methyl-3-propylpyrazole-4,5-diamine (PubChem CID 106259807) has the molecular formula C16H24N4O and a molecular weight of 288.39 g/mol. Its IUPAC name is 5-N-[2-(2-methoxyphenyl)ethyl]-1-methyl-3-propylpyrazole-4,5-diamine.

Molecular Properties

Compound Name5-N-[2-(2-methoxyphenyl)ethyl]-1-methyl-3-propylpyrazole-4,5-diamine
PubChem CID106259807
Molecular FormulaC16H24N4O
Molecular Weight288.39 g/mol
Exact Mass288.20
IUPAC Name5-N-[2-(2-methoxyphenyl)ethyl]-1-methyl-3-propylpyrazole-4,5-diamine
SMILESCCCc1nn(C)c(NCCc2ccccc2OC)c1N
InChIInChI=1S/C16H24N4O/c1-4-7-13-15(17)16(20(2)19-13)18-11-10-12-8-5-6-9-14(12)21-3/h5-6,8-9,18H,4,7,10-11,17H2,1-3H3
InChIKeyWEGGDDQZRJONTE-UHFFFAOYSA-N
XLogP2.62
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 5-N-[2-(2-methoxyphenyl)ethyl]-1-methyl-3-propylpyrazole-4,5-diamine 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

5-N-(3-methoxypropyl)-1-methyl-3-propylpyrazole-4,5-diamine
CID 66019810
5-N-[2-(3,5-difluorophenyl)ethyl]-1-methyl-3-propylpyrazole-4,5-diamine
CID 66019278
3-ethyl-5-N-[2-(4-methoxyphenyl)ethyl]-1-methylpyrazole-4,5-diamine
CID 66014362
2-[(4-amino-1-methyl-3-propylpyrazol-5-yl)amino]-1-phenylethanol
CID 66017879
5-N-(2-cyclohexyloxyethyl)-1-methyl-3-propylpyrazole-4,5-diamine
CID 66017735
3-methoxy-1-N-[2-(2-methoxyphenyl)ethyl]benzene-1,2-diamine
CID 106259906
5-N-[2-(2-fluorophenyl)ethyl]-1,3-dimethylpyrazole-4,5-diamine
CID 43554049
1-methyl-3-propyl-5-N-(5,5,5-trifluoropentyl)pyrazole-4,5-diamine
CID 115515604
6-N-ethyl-4-N-[2-(2-methoxyphenyl)ethyl]pyrimidine-2,4,6-triamine
CID 106262726
5-N-[(2-chloro-6-methoxyphenyl)methyl]-3-ethyl-1-methylpyrazole-4,5-diamine
CID 103291780
5-N-(2,2-difluoroethyl)-1-methyl-3-propylpyrazole-4,5-diamine
CID 115405451
3-amino-N-[2-(2-methoxyphenyl)ethyl]-1-methylpyrazole-4-sulfonamide
CID 106259655

Frequently Asked Questions

What is the IUPAC name of 5-N-[2-(2-methoxyphenyl)ethyl]-1-methyl-3-propylpyrazole-4,5-diamine?
The IUPAC name of 5-N-[2-(2-methoxyphenyl)ethyl]-1-methyl-3-propylpyrazole-4,5-diamine (CID 106259807) is 5-N-[2-(2-methoxyphenyl)ethyl]-1-methyl-3-propylpyrazole-4,5-diamine.
What is the SMILES notation for 5-N-[2-(2-methoxyphenyl)ethyl]-1-methyl-3-propylpyrazole-4,5-diamine?
The canonical SMILES for 5-N-[2-(2-methoxyphenyl)ethyl]-1-methyl-3-propylpyrazole-4,5-diamine is CCCc1nn(C)c(NCCc2ccccc2OC)c1N.
What is the InChIKey of 5-N-[2-(2-methoxyphenyl)ethyl]-1-methyl-3-propylpyrazole-4,5-diamine?
The InChIKey is WEGGDDQZRJONTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O/c1-4-7-13-15(17)16(20(2)19-13)18-11-10-12-8-5-6-9-14(12)21-3/h5-6,8-9,18H,4,7,10-11,17H2,1-3H3.
What are the key properties of 5-N-[2-(2-methoxyphenyl)ethyl]-1-methyl-3-propylpyrazole-4,5-diamine?
5-N-[2-(2-methoxyphenyl)ethyl]-1-methyl-3-propylpyrazole-4,5-diamine has a molecular weight of 288.39 g/mol, XLogP of 2.62, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-[2-(2-methoxyphenyl)ethyl]-1-methyl-3-propylpyrazole-4,5-diamine is sourced from PubChem (CID 106259807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).