N-(5-cyclopropyl-1H-pyrazol-3-yl)acetamide

C8H11N3O — CID 2819087

IUPACN-(5-cyclopropyl-1H-pyrazol-3-yl)acetamide
SMILESCC(=O)Nc1cc(C2CC2)[nH]n1
InChIInChI=1S/C8H11N3O/c1-5(12)9-8-4-7(10-11-8)6-2-3-6/h4,6H,2-3H2,1H3,(H2,9,10,11,12)
InChIKeyCSYMKKGYWKPGMS-UHFFFAOYSA-N
MW165.20 g/mol
LogP1.25
Rot. Bonds2

About N-(5-cyclopropyl-1H-pyrazol-3-yl)acetamide

N-(5-cyclopropyl-1H-pyrazol-3-yl)acetamide (PubChem CID 2819087) has the molecular formula C8H11N3O and a molecular weight of 165.20 g/mol. Its IUPAC name is N-(5-cyclopropyl-1H-pyrazol-3-yl)acetamide.

Molecular Properties

Compound NameN-(5-cyclopropyl-1H-pyrazol-3-yl)acetamide
PubChem CID2819087
Molecular FormulaC8H11N3O
Molecular Weight165.20 g/mol
Exact Mass165.09
IUPAC NameN-(5-cyclopropyl-1H-pyrazol-3-yl)acetamide
SMILESCC(=O)Nc1cc(C2CC2)[nH]n1
InChIInChI=1S/C8H11N3O/c1-5(12)9-8-4-7(10-11-8)6-2-3-6/h4,6H,2-3H2,1H3,(H2,9,10,11,12)
InChIKeyCSYMKKGYWKPGMS-UHFFFAOYSA-N
XLogP1.25
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.20
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(5-cyclopropyl-1H-pyrazol-3-yl)acetamide?
The IUPAC name of N-(5-cyclopropyl-1H-pyrazol-3-yl)acetamide (CID 2819087) is N-(5-cyclopropyl-1H-pyrazol-3-yl)acetamide.
What is the SMILES notation for N-(5-cyclopropyl-1H-pyrazol-3-yl)acetamide?
The canonical SMILES for N-(5-cyclopropyl-1H-pyrazol-3-yl)acetamide is CC(=O)Nc1cc(C2CC2)[nH]n1.
What is the InChIKey of N-(5-cyclopropyl-1H-pyrazol-3-yl)acetamide?
The InChIKey is CSYMKKGYWKPGMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O/c1-5(12)9-8-4-7(10-11-8)6-2-3-6/h4,6H,2-3H2,1H3,(H2,9,10,11,12).
What are the key properties of N-(5-cyclopropyl-1H-pyrazol-3-yl)acetamide?
N-(5-cyclopropyl-1H-pyrazol-3-yl)acetamide has a molecular weight of 165.20 g/mol, XLogP of 1.25, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-cyclopropyl-1H-pyrazol-3-yl)acetamide is sourced from PubChem (CID 2819087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).