3-ethyl-1-methyl-5-N-[2-(1-methylpyrazol-3-yl)ethyl]pyrazole-4,5-diamine

C12H20N6 — CID 106103977

IUPAC3-ethyl-1-methyl-5-N-[2-(1-methylpyrazol-3-yl)ethyl]pyrazole-4,5-diamine
SMILESCCc1nn(C)c(NCCc2ccn(C)n2)c1N
InChIInChI=1S/C12H20N6/c1-4-10-11(13)12(18(3)16-10)14-7-5-9-6-8-17(2)15-9/h6,8,14H,4-5,7,13H2,1-3H3
InChIKeyCNPMRZBJGGJMHR-UHFFFAOYSA-N
MW248.33 g/mol
LogP0.95
Rot. Bonds5

About 3-ethyl-1-methyl-5-N-[2-(1-methylpyrazol-3-yl)ethyl]pyrazole-4,5-diamine

3-ethyl-1-methyl-5-N-[2-(1-methylpyrazol-3-yl)ethyl]pyrazole-4,5-diamine (PubChem CID 106103977) has the molecular formula C12H20N6 and a molecular weight of 248.33 g/mol. Its IUPAC name is 3-ethyl-1-methyl-5-N-[2-(1-methylpyrazol-3-yl)ethyl]pyrazole-4,5-diamine.

Molecular Properties

Compound Name3-ethyl-1-methyl-5-N-[2-(1-methylpyrazol-3-yl)ethyl]pyrazole-4,5-diamine
PubChem CID106103977
Molecular FormulaC12H20N6
Molecular Weight248.33 g/mol
Exact Mass248.17
IUPAC Name3-ethyl-1-methyl-5-N-[2-(1-methylpyrazol-3-yl)ethyl]pyrazole-4,5-diamine
SMILESCCc1nn(C)c(NCCc2ccn(C)n2)c1N
InChIInChI=1S/C12H20N6/c1-4-10-11(13)12(18(3)16-10)14-7-5-9-6-8-17(2)15-9/h6,8,14H,4-5,7,13H2,1-3H3
InChIKeyCNPMRZBJGGJMHR-UHFFFAOYSA-N
XLogP0.95
TPSA73.69 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 50.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 3-ethyl-1-methyl-5-N-[2-(1-methylpyrazol-3-yl)ethyl]pyrazole-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

3-ethyl-1-methyl-N-[2-(1-methylpyrazol-3-yl)ethyl]-4-nitropyrazol-5-amine
CID 104626425
3-ethyl-5-N-[2-(4-methoxyphenyl)ethyl]-1-methylpyrazole-4,5-diamine
CID 66014362
3-ethyl-1-methyl-5-N-pentylpyrazole-4,5-diamine
CID 66014562
5-N-[2-(diethylamino)ethyl]-3-ethyl-1-methylpyrazole-4,5-diamine
CID 66016551
4-[(4-amino-3-ethyl-1-methylpyrazol-5-yl)amino]butanamide
CID 66014592
2-[(4-amino-3-ethyl-1-methylpyrazol-5-yl)amino]ethylurea
CID 83116801
3-ethyl-1-methyl-5-N-[2-(3-methylbutoxy)ethyl]pyrazole-4,5-diamine
CID 66015421
2-N-[2-(1-methylpyrazol-3-yl)ethyl]pyrazine-2,6-diamine
CID 104626530
3-ethyl-5-N-[(4-fluorophenyl)methyl]-1-methylpyrazole-4,5-diamine
CID 66016747
3-ethyl-5-N-[(5-ethylthiophen-2-yl)methyl]-1-methylpyrazole-4,5-diamine
CID 106007265
6-N-[2-(1-methylpyrazol-3-yl)ethyl]pyridine-2,6-diamine
CID 106106717
3-ethoxy-1-N-[2-(1-methylpyrazol-3-yl)ethyl]benzene-1,2-diamine
CID 106104073

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-methyl-5-N-[2-(1-methylpyrazol-3-yl)ethyl]pyrazole-4,5-diamine?
The IUPAC name of 3-ethyl-1-methyl-5-N-[2-(1-methylpyrazol-3-yl)ethyl]pyrazole-4,5-diamine (CID 106103977) is 3-ethyl-1-methyl-5-N-[2-(1-methylpyrazol-3-yl)ethyl]pyrazole-4,5-diamine.
What is the SMILES notation for 3-ethyl-1-methyl-5-N-[2-(1-methylpyrazol-3-yl)ethyl]pyrazole-4,5-diamine?
The canonical SMILES for 3-ethyl-1-methyl-5-N-[2-(1-methylpyrazol-3-yl)ethyl]pyrazole-4,5-diamine is CCc1nn(C)c(NCCc2ccn(C)n2)c1N.
What is the InChIKey of 3-ethyl-1-methyl-5-N-[2-(1-methylpyrazol-3-yl)ethyl]pyrazole-4,5-diamine?
The InChIKey is CNPMRZBJGGJMHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N6/c1-4-10-11(13)12(18(3)16-10)14-7-5-9-6-8-17(2)15-9/h6,8,14H,4-5,7,13H2,1-3H3.
What are the key properties of 3-ethyl-1-methyl-5-N-[2-(1-methylpyrazol-3-yl)ethyl]pyrazole-4,5-diamine?
3-ethyl-1-methyl-5-N-[2-(1-methylpyrazol-3-yl)ethyl]pyrazole-4,5-diamine has a molecular weight of 248.33 g/mol, XLogP of 0.95, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-methyl-5-N-[2-(1-methylpyrazol-3-yl)ethyl]pyrazole-4,5-diamine is sourced from PubChem (CID 106103977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).