2-(2-hydroxyethyl)-N-(1H-pyrazol-5-yl)pyrazole-3-carboxamide

C9H11N5O2 — CID 175923670

IUPAC2-(2-hydroxyethyl)-N-(1H-pyrazol-5-yl)pyrazole-3-carboxamide
SMILESO=C(Nc1ccn[nH]1)c1ccnn1CCO
InChIInChI=1S/C9H11N5O2/c15-6-5-14-7(1-4-11-14)9(16)12-8-2-3-10-13-8/h1-4,15H,5-6H2,(H2,10,12,13,16)
InChIKeyGCJWRXYSCMCTHS-UHFFFAOYSA-N
MW221.22 g/mol
LogP-0.15
Rot. Bonds4

About 2-(2-hydroxyethyl)-N-(1H-pyrazol-5-yl)pyrazole-3-carboxamide

2-(2-hydroxyethyl)-N-(1H-pyrazol-5-yl)pyrazole-3-carboxamide (PubChem CID 175923670) has the molecular formula C9H11N5O2 and a molecular weight of 221.22 g/mol. Its IUPAC name is 2-(2-hydroxyethyl)-N-(1H-pyrazol-5-yl)pyrazole-3-carboxamide.

Molecular Properties

Compound Name2-(2-hydroxyethyl)-N-(1H-pyrazol-5-yl)pyrazole-3-carboxamide
PubChem CID175923670
Molecular FormulaC9H11N5O2
Molecular Weight221.22 g/mol
Exact Mass221.09
IUPAC Name2-(2-hydroxyethyl)-N-(1H-pyrazol-5-yl)pyrazole-3-carboxamide
SMILESO=C(Nc1ccn[nH]1)c1ccnn1CCO
InChIInChI=1S/C9H11N5O2/c15-6-5-14-7(1-4-11-14)9(16)12-8-2-3-10-13-8/h1-4,15H,5-6H2,(H2,10,12,13,16)
InChIKeyGCJWRXYSCMCTHS-UHFFFAOYSA-N
XLogP-0.15
TPSA95.83 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.22
LogP ≤ 5-0.15
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxyethyl)-N-(1H-pyrazol-5-yl)pyrazole-3-carboxamide?
The IUPAC name of 2-(2-hydroxyethyl)-N-(1H-pyrazol-5-yl)pyrazole-3-carboxamide (CID 175923670) is 2-(2-hydroxyethyl)-N-(1H-pyrazol-5-yl)pyrazole-3-carboxamide.
What is the SMILES notation for 2-(2-hydroxyethyl)-N-(1H-pyrazol-5-yl)pyrazole-3-carboxamide?
The canonical SMILES for 2-(2-hydroxyethyl)-N-(1H-pyrazol-5-yl)pyrazole-3-carboxamide is O=C(Nc1ccn[nH]1)c1ccnn1CCO.
What is the InChIKey of 2-(2-hydroxyethyl)-N-(1H-pyrazol-5-yl)pyrazole-3-carboxamide?
The InChIKey is GCJWRXYSCMCTHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N5O2/c15-6-5-14-7(1-4-11-14)9(16)12-8-2-3-10-13-8/h1-4,15H,5-6H2,(H2,10,12,13,16).
What are the key properties of 2-(2-hydroxyethyl)-N-(1H-pyrazol-5-yl)pyrazole-3-carboxamide?
2-(2-hydroxyethyl)-N-(1H-pyrazol-5-yl)pyrazole-3-carboxamide has a molecular weight of 221.22 g/mol, XLogP of -0.15, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxyethyl)-N-(1H-pyrazol-5-yl)pyrazole-3-carboxamide is sourced from PubChem (CID 175923670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).