2-(3-aminopyrazol-1-yl)-N-[2-(dimethylamino)ethyl]-N-methylacetamide

C10H19N5O — CID 63693887

IUPAC2-(3-aminopyrazol-1-yl)-N-[2-(dimethylamino)ethyl]-N-methylacetamide
SMILESCN(C)CCN(C)C(=O)Cn1ccc(N)n1
InChIInChI=1S/C10H19N5O/c1-13(2)6-7-14(3)10(16)8-15-5-4-9(11)12-15/h4-5H,6-8H2,1-3H3,(H2,11,12)
InChIKeyRJOMJLUWLMPZIA-UHFFFAOYSA-N
MW225.30 g/mol
LogP-0.51
Rot. Bonds5

About 2-(3-aminopyrazol-1-yl)-N-[2-(dimethylamino)ethyl]-N-methylacetamide

2-(3-aminopyrazol-1-yl)-N-[2-(dimethylamino)ethyl]-N-methylacetamide (PubChem CID 63693887) has the molecular formula C10H19N5O and a molecular weight of 225.30 g/mol. Its IUPAC name is 2-(3-aminopyrazol-1-yl)-N-[2-(dimethylamino)ethyl]-N-methylacetamide.

Molecular Properties

Compound Name2-(3-aminopyrazol-1-yl)-N-[2-(dimethylamino)ethyl]-N-methylacetamide
PubChem CID63693887
Molecular FormulaC10H19N5O
Molecular Weight225.30 g/mol
Exact Mass225.16
IUPAC Name2-(3-aminopyrazol-1-yl)-N-[2-(dimethylamino)ethyl]-N-methylacetamide
SMILESCN(C)CCN(C)C(=O)Cn1ccc(N)n1
InChIInChI=1S/C10H19N5O/c1-13(2)6-7-14(3)10(16)8-15-5-4-9(11)12-15/h4-5H,6-8H2,1-3H3,(H2,11,12)
InChIKeyRJOMJLUWLMPZIA-UHFFFAOYSA-N
XLogP-0.51
TPSA67.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.30
LogP ≤ 5-0.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(3-aminopyrazol-1-yl)-N-[2-(dimethylamino)ethyl]-N-methylacetamide?
The IUPAC name of 2-(3-aminopyrazol-1-yl)-N-[2-(dimethylamino)ethyl]-N-methylacetamide (CID 63693887) is 2-(3-aminopyrazol-1-yl)-N-[2-(dimethylamino)ethyl]-N-methylacetamide.
What is the SMILES notation for 2-(3-aminopyrazol-1-yl)-N-[2-(dimethylamino)ethyl]-N-methylacetamide?
The canonical SMILES for 2-(3-aminopyrazol-1-yl)-N-[2-(dimethylamino)ethyl]-N-methylacetamide is CN(C)CCN(C)C(=O)Cn1ccc(N)n1.
What is the InChIKey of 2-(3-aminopyrazol-1-yl)-N-[2-(dimethylamino)ethyl]-N-methylacetamide?
The InChIKey is RJOMJLUWLMPZIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N5O/c1-13(2)6-7-14(3)10(16)8-15-5-4-9(11)12-15/h4-5H,6-8H2,1-3H3,(H2,11,12).
What are the key properties of 2-(3-aminopyrazol-1-yl)-N-[2-(dimethylamino)ethyl]-N-methylacetamide?
2-(3-aminopyrazol-1-yl)-N-[2-(dimethylamino)ethyl]-N-methylacetamide has a molecular weight of 225.30 g/mol, XLogP of -0.51, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-aminopyrazol-1-yl)-N-[2-(dimethylamino)ethyl]-N-methylacetamide is sourced from PubChem (CID 63693887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).