N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]acetamide

C12H14N4O — CID 71807890

IUPACN-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]acetamide
SMILESCC(=O)NCCn1ccc(-c2ccccn2)n1
InChIInChI=1S/C12H14N4O/c1-10(17)13-7-9-16-8-5-12(15-16)11-4-2-3-6-14-11/h2-6,8H,7,9H2,1H3,(H,13,17)
InChIKeySRCXKOMBMPPMHZ-UHFFFAOYSA-N
MW230.27 g/mol
LogP1.08
Rot. Bonds4

About N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]acetamide

N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]acetamide (PubChem CID 71807890) has the molecular formula C12H14N4O and a molecular weight of 230.27 g/mol. Its IUPAC name is N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]acetamide.

Molecular Properties

Compound NameN-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]acetamide
PubChem CID71807890
Molecular FormulaC12H14N4O
Molecular Weight230.27 g/mol
Exact Mass230.12
IUPAC NameN-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]acetamide
SMILESCC(=O)NCCn1ccc(-c2ccccn2)n1
InChIInChI=1S/C12H14N4O/c1-10(17)13-7-9-16-8-5-12(15-16)11-4-2-3-6-14-11/h2-6,8H,7,9H2,1H3,(H,13,17)
InChIKeySRCXKOMBMPPMHZ-UHFFFAOYSA-N
XLogP1.08
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]acetamide 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

N-[2-(2-methyl-8,9-dihydro-7H-cyclopenta[c]pyrazolo[1,5-a]pyridin-9-yl)ethyl]acetamide
CID 59145922
Acetamide, N-(1-phenylpyrazol-4-yl)-
CID 200720
2-(1H-Pyrazol-3-Yl)Pyridine
CID 2797657
N-(pyridin-2-ylmethyl)acetamide
CID 5084090
2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-(pyridin-3-ylmethyl)acetamide
CID 1259244
2-(5-methyl-1H-pyrazol-1-yl)-N'-[(E)-(6-methylpyridin-2-yl)methylidene]acetohydrazide
CID 6879191
2-(3,5-dimethyl-1H-pyrazol-1-yl)-N'-[(E)-pyridin-2-ylmethylidene]acetohydrazide
CID 6889248
2-(3,5-dimethyl-1H-pyrazol-1-yl)-N'-[(E)-(6-methylpyridin-2-yl)methylidene]acetohydrazide
CID 9557727
N-(1-phenylpyrazol-4-yl)-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide
CID 141484735
Pyridine, 4-(4-aminopyrazol-1-yl)-
CID 206684
1-methyl-N-(pyridin-3-yl)-1H-pyrazole-5-carboxamide
CID 649594
2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N-3-pyridinylacetamide
CID 1257381

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]acetamide?
The IUPAC name of N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]acetamide (CID 71807890) is N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]acetamide.
What is the SMILES notation for N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]acetamide?
The canonical SMILES for N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]acetamide is CC(=O)NCCn1ccc(-c2ccccn2)n1.
What is the InChIKey of N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]acetamide?
The InChIKey is SRCXKOMBMPPMHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O/c1-10(17)13-7-9-16-8-5-12(15-16)11-4-2-3-6-14-11/h2-6,8H,7,9H2,1H3,(H,13,17).
What are the key properties of N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]acetamide?
N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]acetamide has a molecular weight of 230.27 g/mol, XLogP of 1.08, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]acetamide is sourced from PubChem (CID 71807890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).