2-[2-(3-aminopyrazol-1-yl)ethyl-methylamino]-N-cyclopropylacetamide

C11H19N5O — CID 55206025

IUPAC2-[2-(3-aminopyrazol-1-yl)ethyl-methylamino]-N-cyclopropylacetamide
SMILESCN(CCn1ccc(N)n1)CC(=O)NC1CC1
InChIInChI=1S/C11H19N5O/c1-15(8-11(17)13-9-2-3-9)6-7-16-5-4-10(12)14-16/h4-5,9H,2-3,6-8H2,1H3,(H2,12,14)(H,13,17)
InChIKeyRPPDRZMLADWNEW-UHFFFAOYSA-N
MW237.31 g/mol
LogP-0.32
Rot. Bonds6

About 2-[2-(3-aminopyrazol-1-yl)ethyl-methylamino]-N-cyclopropylacetamide

2-[2-(3-aminopyrazol-1-yl)ethyl-methylamino]-N-cyclopropylacetamide (PubChem CID 55206025) has the molecular formula C11H19N5O and a molecular weight of 237.31 g/mol. Its IUPAC name is 2-[2-(3-aminopyrazol-1-yl)ethyl-methylamino]-N-cyclopropylacetamide.

Molecular Properties

Compound Name2-[2-(3-aminopyrazol-1-yl)ethyl-methylamino]-N-cyclopropylacetamide
PubChem CID55206025
Molecular FormulaC11H19N5O
Molecular Weight237.31 g/mol
Exact Mass237.16
IUPAC Name2-[2-(3-aminopyrazol-1-yl)ethyl-methylamino]-N-cyclopropylacetamide
SMILESCN(CCn1ccc(N)n1)CC(=O)NC1CC1
InChIInChI=1S/C11H19N5O/c1-15(8-11(17)13-9-2-3-9)6-7-16-5-4-10(12)14-16/h4-5,9H,2-3,6-8H2,1H3,(H2,12,14)(H,13,17)
InChIKeyRPPDRZMLADWNEW-UHFFFAOYSA-N
XLogP-0.32
TPSA76.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.31
LogP ≤ 5-0.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(3-aminopyrazol-1-yl)ethyl-methylamino]-N-cyclopropylacetamide?
The IUPAC name of 2-[2-(3-aminopyrazol-1-yl)ethyl-methylamino]-N-cyclopropylacetamide (CID 55206025) is 2-[2-(3-aminopyrazol-1-yl)ethyl-methylamino]-N-cyclopropylacetamide.
What is the SMILES notation for 2-[2-(3-aminopyrazol-1-yl)ethyl-methylamino]-N-cyclopropylacetamide?
The canonical SMILES for 2-[2-(3-aminopyrazol-1-yl)ethyl-methylamino]-N-cyclopropylacetamide is CN(CCn1ccc(N)n1)CC(=O)NC1CC1.
What is the InChIKey of 2-[2-(3-aminopyrazol-1-yl)ethyl-methylamino]-N-cyclopropylacetamide?
The InChIKey is RPPDRZMLADWNEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5O/c1-15(8-11(17)13-9-2-3-9)6-7-16-5-4-10(12)14-16/h4-5,9H,2-3,6-8H2,1H3,(H2,12,14)(H,13,17).
What are the key properties of 2-[2-(3-aminopyrazol-1-yl)ethyl-methylamino]-N-cyclopropylacetamide?
2-[2-(3-aminopyrazol-1-yl)ethyl-methylamino]-N-cyclopropylacetamide has a molecular weight of 237.31 g/mol, XLogP of -0.32, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(3-aminopyrazol-1-yl)ethyl-methylamino]-N-cyclopropylacetamide is sourced from PubChem (CID 55206025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).