N-[2-(2-hydroxyethyl)pyrazol-3-yl]formamide

C6H9N3O2 — CID 15077737

IUPACN-[2-(2-hydroxyethyl)pyrazol-3-yl]formamide
SMILESO=CNc1ccnn1CCO
InChIInChI=1S/C6H9N3O2/c10-4-3-9-6(7-5-11)1-2-8-9/h1-2,5,10H,3-4H2,(H,7,11)
InChIKeySBGVMZDALRWZPU-UHFFFAOYSA-N
MW155.16 g/mol
LogP-0.56
Rot. Bonds4

About N-[2-(2-hydroxyethyl)pyrazol-3-yl]formamide

N-[2-(2-hydroxyethyl)pyrazol-3-yl]formamide (PubChem CID 15077737) has the molecular formula C6H9N3O2 and a molecular weight of 155.16 g/mol. Its IUPAC name is N-[2-(2-hydroxyethyl)pyrazol-3-yl]formamide.

Molecular Properties

Compound NameN-[2-(2-hydroxyethyl)pyrazol-3-yl]formamide
PubChem CID15077737
Molecular FormulaC6H9N3O2
Molecular Weight155.16 g/mol
Exact Mass155.07
IUPAC NameN-[2-(2-hydroxyethyl)pyrazol-3-yl]formamide
SMILESO=CNc1ccnn1CCO
InChIInChI=1S/C6H9N3O2/c10-4-3-9-6(7-5-11)1-2-8-9/h1-2,5,10H,3-4H2,(H,7,11)
InChIKeySBGVMZDALRWZPU-UHFFFAOYSA-N
XLogP-0.56
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.16
LogP ≤ 5-0.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2-hydroxyethyl)pyrazol-3-yl]formamide?
The IUPAC name of N-[2-(2-hydroxyethyl)pyrazol-3-yl]formamide (CID 15077737) is N-[2-(2-hydroxyethyl)pyrazol-3-yl]formamide.
What is the SMILES notation for N-[2-(2-hydroxyethyl)pyrazol-3-yl]formamide?
The canonical SMILES for N-[2-(2-hydroxyethyl)pyrazol-3-yl]formamide is O=CNc1ccnn1CCO.
What is the InChIKey of N-[2-(2-hydroxyethyl)pyrazol-3-yl]formamide?
The InChIKey is SBGVMZDALRWZPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3O2/c10-4-3-9-6(7-5-11)1-2-8-9/h1-2,5,10H,3-4H2,(H,7,11).
What are the key properties of N-[2-(2-hydroxyethyl)pyrazol-3-yl]formamide?
N-[2-(2-hydroxyethyl)pyrazol-3-yl]formamide has a molecular weight of 155.16 g/mol, XLogP of -0.56, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-hydroxyethyl)pyrazol-3-yl]formamide is sourced from PubChem (CID 15077737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).