2-[2-(4-aminopyrazol-1-yl)ethyl-ethylamino]acetamide

C9H17N5O — CID 103101391

IUPAC2-[2-(4-aminopyrazol-1-yl)ethyl-ethylamino]acetamide
SMILESCCN(CCn1cc(N)cn1)CC(N)=O
InChIInChI=1S/C9H17N5O/c1-2-13(7-9(11)15)3-4-14-6-8(10)5-12-14/h5-6H,2-4,7,10H2,1H3,(H2,11,15)
InChIKeyGEZBEQLZUWUQPH-UHFFFAOYSA-N
MW211.27 g/mol
LogP-0.73
Rot. Bonds6

About 2-[2-(4-aminopyrazol-1-yl)ethyl-ethylamino]acetamide

2-[2-(4-aminopyrazol-1-yl)ethyl-ethylamino]acetamide (PubChem CID 103101391) has the molecular formula C9H17N5O and a molecular weight of 211.27 g/mol. Its IUPAC name is 2-[2-(4-aminopyrazol-1-yl)ethyl-ethylamino]acetamide.

Molecular Properties

Compound Name2-[2-(4-aminopyrazol-1-yl)ethyl-ethylamino]acetamide
PubChem CID103101391
Molecular FormulaC9H17N5O
Molecular Weight211.27 g/mol
Exact Mass211.14
IUPAC Name2-[2-(4-aminopyrazol-1-yl)ethyl-ethylamino]acetamide
SMILESCCN(CCn1cc(N)cn1)CC(N)=O
InChIInChI=1S/C9H17N5O/c1-2-13(7-9(11)15)3-4-14-6-8(10)5-12-14/h5-6H,2-4,7,10H2,1H3,(H2,11,15)
InChIKeyGEZBEQLZUWUQPH-UHFFFAOYSA-N
XLogP-0.73
TPSA90.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.27
LogP ≤ 5-0.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-[2-(4-aminopyrazol-1-yl)ethyl-ethylamino]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-aminopyrazol-1-yl)ethyl-ethylamino]acetamide?
The IUPAC name of 2-[2-(4-aminopyrazol-1-yl)ethyl-ethylamino]acetamide (CID 103101391) is 2-[2-(4-aminopyrazol-1-yl)ethyl-ethylamino]acetamide.
What is the SMILES notation for 2-[2-(4-aminopyrazol-1-yl)ethyl-ethylamino]acetamide?
The canonical SMILES for 2-[2-(4-aminopyrazol-1-yl)ethyl-ethylamino]acetamide is CCN(CCn1cc(N)cn1)CC(N)=O.
What is the InChIKey of 2-[2-(4-aminopyrazol-1-yl)ethyl-ethylamino]acetamide?
The InChIKey is GEZBEQLZUWUQPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N5O/c1-2-13(7-9(11)15)3-4-14-6-8(10)5-12-14/h5-6H,2-4,7,10H2,1H3,(H2,11,15).
What are the key properties of 2-[2-(4-aminopyrazol-1-yl)ethyl-ethylamino]acetamide?
2-[2-(4-aminopyrazol-1-yl)ethyl-ethylamino]acetamide has a molecular weight of 211.27 g/mol, XLogP of -0.73, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-aminopyrazol-1-yl)ethyl-ethylamino]acetamide is sourced from PubChem (CID 103101391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).