N-[2-(4-aminopyrazol-1-yl)ethyl]-6-propoxypyrazin-2-amine

C12H18N6O — CID 115320144

IUPACN-[2-(4-aminopyrazol-1-yl)ethyl]-6-propoxypyrazin-2-amine
SMILESCCCOc1cncc(NCCn2cc(N)cn2)n1
InChIInChI=1S/C12H18N6O/c1-2-5-19-12-8-14-7-11(17-12)15-3-4-18-9-10(13)6-16-18/h6-9H,2-5,13H2,1H3,(H,15,17)
InChIKeyHRKRGNYNYFRBPX-UHFFFAOYSA-N
MW262.32 g/mol
LogP1.16
Rot. Bonds7

About N-[2-(4-aminopyrazol-1-yl)ethyl]-6-propoxypyrazin-2-amine

N-[2-(4-aminopyrazol-1-yl)ethyl]-6-propoxypyrazin-2-amine (PubChem CID 115320144) has the molecular formula C12H18N6O and a molecular weight of 262.32 g/mol. Its IUPAC name is N-[2-(4-aminopyrazol-1-yl)ethyl]-6-propoxypyrazin-2-amine.

Molecular Properties

Compound NameN-[2-(4-aminopyrazol-1-yl)ethyl]-6-propoxypyrazin-2-amine
PubChem CID115320144
Molecular FormulaC12H18N6O
Molecular Weight262.32 g/mol
Exact Mass262.15
IUPAC NameN-[2-(4-aminopyrazol-1-yl)ethyl]-6-propoxypyrazin-2-amine
SMILESCCCOc1cncc(NCCn2cc(N)cn2)n1
InChIInChI=1S/C12H18N6O/c1-2-5-19-12-8-14-7-11(17-12)15-3-4-18-9-10(13)6-16-18/h6-9H,2-5,13H2,1H3,(H,15,17)
InChIKeyHRKRGNYNYFRBPX-UHFFFAOYSA-N
XLogP1.16
TPSA90.88 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.32
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze N-[2-(4-aminopyrazol-1-yl)ethyl]-6-propoxypyrazin-2-amine 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

6-butoxy-N-ethylpyrazin-2-amine
CID 80865504
N-[2-(4-aminopyrazol-1-yl)ethyl]pyridin-2-amine
CID 115320029
3,3-dimethyl-2-N-(6-propoxypyrazin-2-yl)butane-1,2-diamine
CID 114208188
N-[2-(4-aminopyrazol-1-yl)ethyl]-5-methylpyrimidin-2-amine
CID 115320119
1-(2-ethoxyethyl)pyrazol-4-amine
CID 43457185
N-[2-(4-aminopyrazol-1-yl)ethyl]propane-1-sulfonamide
CID 115319872
N'-(6-ethoxypyrazin-2-yl)pentane-1,5-diamine
CID 107323521
1-[2-(4-methoxyphenoxy)ethyl]pyrazol-4-amine
CID 62137352
1-[2-(4-ethoxyphenoxy)ethyl]pyrazol-4-amine
CID 62138455
4-propoxy-1-propylpyrazole
CID 116805185
N-[2-(4-propoxypyrazol-1-yl)ethyl]aniline
CID 114274287
6-(2-cyclobutylethoxy)-N-propylpyrazin-2-amine
CID 114158245

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-aminopyrazol-1-yl)ethyl]-6-propoxypyrazin-2-amine?
The IUPAC name of N-[2-(4-aminopyrazol-1-yl)ethyl]-6-propoxypyrazin-2-amine (CID 115320144) is N-[2-(4-aminopyrazol-1-yl)ethyl]-6-propoxypyrazin-2-amine.
What is the SMILES notation for N-[2-(4-aminopyrazol-1-yl)ethyl]-6-propoxypyrazin-2-amine?
The canonical SMILES for N-[2-(4-aminopyrazol-1-yl)ethyl]-6-propoxypyrazin-2-amine is CCCOc1cncc(NCCn2cc(N)cn2)n1.
What is the InChIKey of N-[2-(4-aminopyrazol-1-yl)ethyl]-6-propoxypyrazin-2-amine?
The InChIKey is HRKRGNYNYFRBPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N6O/c1-2-5-19-12-8-14-7-11(17-12)15-3-4-18-9-10(13)6-16-18/h6-9H,2-5,13H2,1H3,(H,15,17).
What are the key properties of N-[2-(4-aminopyrazol-1-yl)ethyl]-6-propoxypyrazin-2-amine?
N-[2-(4-aminopyrazol-1-yl)ethyl]-6-propoxypyrazin-2-amine has a molecular weight of 262.32 g/mol, XLogP of 1.16, 7 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-aminopyrazol-1-yl)ethyl]-6-propoxypyrazin-2-amine is sourced from PubChem (CID 115320144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).