5-N-(2-ethoxyethyl)-1-ethyl-3-methylpyrazole-4,5-diamine

C10H20N4O — CID 66012621

IUPAC5-N-(2-ethoxyethyl)-1-ethyl-3-methylpyrazole-4,5-diamine
SMILESCCOCCNc1c(N)c(C)nn1CC
InChIInChI=1S/C10H20N4O/c1-4-14-10(9(11)8(3)13-14)12-6-7-15-5-2/h12H,4-7,11H2,1-3H3
InChIKeySXADMXKDGQXYHV-UHFFFAOYSA-N
MW212.30 g/mol
LogP1.24
Rot. Bonds6

About 5-N-(2-ethoxyethyl)-1-ethyl-3-methylpyrazole-4,5-diamine

5-N-(2-ethoxyethyl)-1-ethyl-3-methylpyrazole-4,5-diamine (PubChem CID 66012621) has the molecular formula C10H20N4O and a molecular weight of 212.30 g/mol. Its IUPAC name is 5-N-(2-ethoxyethyl)-1-ethyl-3-methylpyrazole-4,5-diamine.

Molecular Properties

Compound Name5-N-(2-ethoxyethyl)-1-ethyl-3-methylpyrazole-4,5-diamine
PubChem CID66012621
Molecular FormulaC10H20N4O
Molecular Weight212.30 g/mol
Exact Mass212.16
IUPAC Name5-N-(2-ethoxyethyl)-1-ethyl-3-methylpyrazole-4,5-diamine
SMILESCCOCCNc1c(N)c(C)nn1CC
InChIInChI=1S/C10H20N4O/c1-4-14-10(9(11)8(3)13-14)12-6-7-15-5-2/h12H,4-7,11H2,1-3H3
InChIKeySXADMXKDGQXYHV-UHFFFAOYSA-N
XLogP1.24
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.30
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

5-N-(2-butoxyethyl)-1-ethyl-3-methylpyrazole-4,5-diamine
CID 66012649
1-ethyl-3-methyl-5-N-(3-methylbutyl)pyrazole-4,5-diamine
CID 66011030
1-ethyl-3-methyl-5-N-(4-methylpentyl)pyrazole-4,5-diamine
CID 66012859
1-ethyl-3-methyl-5-N-[2-(3-methylphenoxy)ethyl]pyrazole-4,5-diamine
CID 66011672
1-ethyl-3-methyl-5-N-[2-(trifluoromethylsulfanyl)ethyl]pyrazole-4,5-diamine
CID 106426553
1-ethyl-3-methyl-5-N-(5-methylhexyl)pyrazole-4,5-diamine
CID 113287312
5-N-(2-cyclopentylethyl)-1-ethyl-3-methylpyrazole-4,5-diamine
CID 66011257
5-N-(2,2-difluoroethyl)-1-ethyl-3-methylpyrazole-4,5-diamine
CID 115405464
1-ethyl-3-methyl-5-N-(2,2,2-trifluoroethyl)pyrazole-4,5-diamine
CID 66012005
3-[[(4-amino-1-ethyl-3-methylpyrazol-5-yl)amino]methyl]pentan-3-ol
CID 66012284
3-[(4-amino-1-ethyl-3-methylpyrazol-5-yl)amino]-N-butan-2-ylpropanamide
CID 66012063
5-N-[2-(cyclopenten-1-yl)ethyl]-1-ethyl-3-methylpyrazole-4,5-diamine
CID 106166404

Frequently Asked Questions

What is the IUPAC name of 5-N-(2-ethoxyethyl)-1-ethyl-3-methylpyrazole-4,5-diamine?
The IUPAC name of 5-N-(2-ethoxyethyl)-1-ethyl-3-methylpyrazole-4,5-diamine (CID 66012621) is 5-N-(2-ethoxyethyl)-1-ethyl-3-methylpyrazole-4,5-diamine.
What is the SMILES notation for 5-N-(2-ethoxyethyl)-1-ethyl-3-methylpyrazole-4,5-diamine?
The canonical SMILES for 5-N-(2-ethoxyethyl)-1-ethyl-3-methylpyrazole-4,5-diamine is CCOCCNc1c(N)c(C)nn1CC.
What is the InChIKey of 5-N-(2-ethoxyethyl)-1-ethyl-3-methylpyrazole-4,5-diamine?
The InChIKey is SXADMXKDGQXYHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N4O/c1-4-14-10(9(11)8(3)13-14)12-6-7-15-5-2/h12H,4-7,11H2,1-3H3.
What are the key properties of 5-N-(2-ethoxyethyl)-1-ethyl-3-methylpyrazole-4,5-diamine?
5-N-(2-ethoxyethyl)-1-ethyl-3-methylpyrazole-4,5-diamine has a molecular weight of 212.30 g/mol, XLogP of 1.24, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-(2-ethoxyethyl)-1-ethyl-3-methylpyrazole-4,5-diamine is sourced from PubChem (CID 66012621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).