2-(4-aminopyrazol-1-yl)-N-(2-pyridin-2-ylethyl)acetamide

C12H15N5O — CID 43382460

IUPAC2-(4-aminopyrazol-1-yl)-N-(2-pyridin-2-ylethyl)acetamide
SMILESNc1cnn(CC(=O)NCCc2ccccn2)c1
InChIInChI=1S/C12H15N5O/c13-10-7-16-17(8-10)9-12(18)15-6-4-11-3-1-2-5-14-11/h1-3,5,7-8H,4,6,9,13H2,(H,15,18)
InChIKeyMXUPHWSAMCQNLZ-UHFFFAOYSA-N
MW245.29 g/mol
LogP0.22
Rot. Bonds5

About 2-(4-aminopyrazol-1-yl)-N-(2-pyridin-2-ylethyl)acetamide

2-(4-aminopyrazol-1-yl)-N-(2-pyridin-2-ylethyl)acetamide (PubChem CID 43382460) has the molecular formula C12H15N5O and a molecular weight of 245.29 g/mol. Its IUPAC name is 2-(4-aminopyrazol-1-yl)-N-(2-pyridin-2-ylethyl)acetamide.

Molecular Properties

Compound Name2-(4-aminopyrazol-1-yl)-N-(2-pyridin-2-ylethyl)acetamide
PubChem CID43382460
Molecular FormulaC12H15N5O
Molecular Weight245.29 g/mol
Exact Mass245.13
IUPAC Name2-(4-aminopyrazol-1-yl)-N-(2-pyridin-2-ylethyl)acetamide
SMILESNc1cnn(CC(=O)NCCc2ccccn2)c1
InChIInChI=1S/C12H15N5O/c13-10-7-16-17(8-10)9-12(18)15-6-4-11-3-1-2-5-14-11/h1-3,5,7-8H,4,6,9,13H2,(H,15,18)
InChIKeyMXUPHWSAMCQNLZ-UHFFFAOYSA-N
XLogP0.22
TPSA85.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.29
LogP ≤ 50.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-aminopyrazol-1-yl)-N-(pyridin-2-ylmethyl)acetamide
CID 43445218
2-(4-aminopyrazol-1-yl)-N-(2-hydroxyethyl)acetamide
CID 43445471
2-[4-(methanesulfonamido)triazol-1-yl]-N-(2-pyridin-2-ylethyl)acetamide
CID 112530298
2-(4-aminopyrazol-1-yl)-N-benzylacetamide
CID 28973852
2-(4-aminopyrazol-1-yl)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]acetamide
CID 114138928
2-(4-aminopyrazol-1-yl)-N-[2-(5-chlorothiophen-2-yl)ethyl]acetamide
CID 114138951
2-(5-methyl-2,4-dioxopyrimidin-1-yl)-N-(2-pyridin-2-ylethyl)acetamide
CID 45280797
2-(4-phenylpiperazin-1-yl)-N-(2-pyridin-2-ylethyl)acetamide
CID 42859124
2-[[2-(4-aminopyrazol-1-yl)acetyl]amino]ethyl carbamate
CID 83201957
2-pyridin-2-ylethylcarbamothioic S-acid
CID 87074091
4-amino-3,3-dimethyl-N-(2-pyridin-2-ylethyl)butanamide
CID 115157427
3-amino-N-(2-pyridin-2-ylethyl)benzamide
CID 24704285

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminopyrazol-1-yl)-N-(2-pyridin-2-ylethyl)acetamide?
The IUPAC name of 2-(4-aminopyrazol-1-yl)-N-(2-pyridin-2-ylethyl)acetamide (CID 43382460) is 2-(4-aminopyrazol-1-yl)-N-(2-pyridin-2-ylethyl)acetamide.
What is the SMILES notation for 2-(4-aminopyrazol-1-yl)-N-(2-pyridin-2-ylethyl)acetamide?
The canonical SMILES for 2-(4-aminopyrazol-1-yl)-N-(2-pyridin-2-ylethyl)acetamide is Nc1cnn(CC(=O)NCCc2ccccn2)c1.
What is the InChIKey of 2-(4-aminopyrazol-1-yl)-N-(2-pyridin-2-ylethyl)acetamide?
The InChIKey is MXUPHWSAMCQNLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N5O/c13-10-7-16-17(8-10)9-12(18)15-6-4-11-3-1-2-5-14-11/h1-3,5,7-8H,4,6,9,13H2,(H,15,18).
What are the key properties of 2-(4-aminopyrazol-1-yl)-N-(2-pyridin-2-ylethyl)acetamide?
2-(4-aminopyrazol-1-yl)-N-(2-pyridin-2-ylethyl)acetamide has a molecular weight of 245.29 g/mol, XLogP of 0.22, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminopyrazol-1-yl)-N-(2-pyridin-2-ylethyl)acetamide is sourced from PubChem (CID 43382460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).