N-ethylacetamide;1H-pyrazole

C7H13N3O — CID 159880833

IUPACN-ethylacetamide;1H-pyrazole
SMILESCCNC(C)=O.c1cn[nH]c1
InChIInChI=1S/C4H9NO.C3H4N2/c1-3-5-4(2)6;1-2-4-5-3-1/h3H2,1-2H3,(H,5,6);1-3H,(H,4,5)
InChIKeyNTMQNZPCBMEGST-UHFFFAOYSA-N
MW155.20 g/mol
LogP0.55
Rot. Bonds1

About N-ethylacetamide;1H-pyrazole

N-ethylacetamide;1H-pyrazole (PubChem CID 159880833) has the molecular formula C7H13N3O and a molecular weight of 155.20 g/mol. Its IUPAC name is N-ethylacetamide;1H-pyrazole.

Molecular Properties

Compound NameN-ethylacetamide;1H-pyrazole
PubChem CID159880833
Molecular FormulaC7H13N3O
Molecular Weight155.20 g/mol
Exact Mass155.11
IUPAC NameN-ethylacetamide;1H-pyrazole
SMILESCCNC(C)=O.c1cn[nH]c1
InChIInChI=1S/C4H9NO.C3H4N2/c1-3-5-4(2)6;1-2-4-5-3-1/h3H2,1-2H3,(H,5,6);1-3H,(H,4,5)
InChIKeyNTMQNZPCBMEGST-UHFFFAOYSA-N
XLogP0.55
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 50.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-ethylacetamide;1H-pyrazole 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 N-ethylacetamide;1H-pyrazole?
The IUPAC name of N-ethylacetamide;1H-pyrazole (CID 159880833) is N-ethylacetamide;1H-pyrazole.
What is the SMILES notation for N-ethylacetamide;1H-pyrazole?
The canonical SMILES for N-ethylacetamide;1H-pyrazole is CCNC(C)=O.c1cn[nH]c1.
What is the InChIKey of N-ethylacetamide;1H-pyrazole?
The InChIKey is NTMQNZPCBMEGST-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9NO.C3H4N2/c1-3-5-4(2)6;1-2-4-5-3-1/h3H2,1-2H3,(H,5,6);1-3H,(H,4,5).
What are the key properties of N-ethylacetamide;1H-pyrazole?
N-ethylacetamide;1H-pyrazole has a molecular weight of 155.20 g/mol, XLogP of 0.55, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethylacetamide;1H-pyrazole is sourced from PubChem (CID 159880833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).