3-[2-(5-amino-1-ethylpyrazol-3-yl)propan-2-yl]-1-ethylpyrazol-5-amine;dihydrochloride

C13H24Cl2N6 — CID 102565475

IUPAC3-[2-(5-amino-1-ethylpyrazol-3-yl)propan-2-yl]-1-ethylpyrazol-5-amine;dihydrochloride
SMILESCCn1nc(C(C)(C)c2cc(N)n(CC)n2)cc1N.Cl.Cl
InChIInChI=1S/C13H22N6.2ClH/c1-5-18-11(14)7-9(16-18)13(3,4)10-8-12(15)19(6-2)17-10;;/h7-8H,5-6,14-15H2,1-4H3;2*1H
InChIKeyFUVHLPZFIFNORI-UHFFFAOYSA-N
MW335.28 g/mol
LogP2.45
Rot. Bonds4

About 3-[2-(5-amino-1-ethylpyrazol-3-yl)propan-2-yl]-1-ethylpyrazol-5-amine;dihydrochloride

3-[2-(5-amino-1-ethylpyrazol-3-yl)propan-2-yl]-1-ethylpyrazol-5-amine;dihydrochloride (PubChem CID 102565475) has the molecular formula C13H24Cl2N6 and a molecular weight of 335.28 g/mol. Its IUPAC name is 3-[2-(5-amino-1-ethylpyrazol-3-yl)propan-2-yl]-1-ethylpyrazol-5-amine;dihydrochloride.

Molecular Properties

Compound Name3-[2-(5-amino-1-ethylpyrazol-3-yl)propan-2-yl]-1-ethylpyrazol-5-amine;dihydrochloride
PubChem CID102565475
Molecular FormulaC13H24Cl2N6
Molecular Weight335.28 g/mol
Exact Mass334.14
IUPAC Name3-[2-(5-amino-1-ethylpyrazol-3-yl)propan-2-yl]-1-ethylpyrazol-5-amine;dihydrochloride
SMILESCCn1nc(C(C)(C)c2cc(N)n(CC)n2)cc1N.Cl.Cl
InChIInChI=1S/C13H22N6.2ClH/c1-5-18-11(14)7-9(16-18)13(3,4)10-8-12(15)19(6-2)17-10;;/h7-8H,5-6,14-15H2,1-4H3;2*1H
InChIKeyFUVHLPZFIFNORI-UHFFFAOYSA-N
XLogP2.45
TPSA87.68 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.28
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 3-[2-(5-amino-1-ethylpyrazol-3-yl)propan-2-yl]-1-ethylpyrazol-5-amine;dihydrochloride 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

1-ethyl-3-(trifluoromethyl)pyrazol-5-amine
CID 19623304
1-ethyl-3-nitropyrazol-5-amine
CID 146680468
3-tert-butyl-1-(2-ethoxyethyl)pyrazol-5-amine
CID 121222599
3-(5-amino-3-tert-butylpyrazol-1-yl)propanenitrile
CID 22217734
methyl 2-(5-amino-3-tert-butylpyrazol-1-yl)acetate
CID 121214084
1-ethyl-3-(2-methylfuran-3-yl)pyrazol-5-amine
CID 61265895
S-methyl 5-amino-1-ethylpyrazole-3-carbothioate
CID 117215487
(5-amino-1-ethylpyrazol-3-yl)-methylsulfonylmethanone
CID 117215438
2-(5-amino-3-tert-butylpyrazol-1-yl)ethylurea
CID 143553767
1-[(2-bromophenyl)methyl]-3-tert-butylpyrazol-5-amine
CID 63276489
3-tert-butyl-1-(4-ethylphenyl)pyrazol-5-amine;hydrochloride
CID 68538663
1-ethyl-3-(3-fluorophenyl)pyrazol-5-amine
CID 61265903

Frequently Asked Questions

What is the IUPAC name of 3-[2-(5-amino-1-ethylpyrazol-3-yl)propan-2-yl]-1-ethylpyrazol-5-amine;dihydrochloride?
The IUPAC name of 3-[2-(5-amino-1-ethylpyrazol-3-yl)propan-2-yl]-1-ethylpyrazol-5-amine;dihydrochloride (CID 102565475) is 3-[2-(5-amino-1-ethylpyrazol-3-yl)propan-2-yl]-1-ethylpyrazol-5-amine;dihydrochloride.
What is the SMILES notation for 3-[2-(5-amino-1-ethylpyrazol-3-yl)propan-2-yl]-1-ethylpyrazol-5-amine;dihydrochloride?
The canonical SMILES for 3-[2-(5-amino-1-ethylpyrazol-3-yl)propan-2-yl]-1-ethylpyrazol-5-amine;dihydrochloride is CCn1nc(C(C)(C)c2cc(N)n(CC)n2)cc1N.Cl.Cl.
What is the InChIKey of 3-[2-(5-amino-1-ethylpyrazol-3-yl)propan-2-yl]-1-ethylpyrazol-5-amine;dihydrochloride?
The InChIKey is FUVHLPZFIFNORI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N6.2ClH/c1-5-18-11(14)7-9(16-18)13(3,4)10-8-12(15)19(6-2)17-10;;/h7-8H,5-6,14-15H2,1-4H3;2*1H.
What are the key properties of 3-[2-(5-amino-1-ethylpyrazol-3-yl)propan-2-yl]-1-ethylpyrazol-5-amine;dihydrochloride?
3-[2-(5-amino-1-ethylpyrazol-3-yl)propan-2-yl]-1-ethylpyrazol-5-amine;dihydrochloride has a molecular weight of 335.28 g/mol, XLogP of 2.45, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(5-amino-1-ethylpyrazol-3-yl)propan-2-yl]-1-ethylpyrazol-5-amine;dihydrochloride is sourced from PubChem (CID 102565475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).