3-amino-5-phenyl-1H-pyrazole-4-carboxamide

C10H10N4O — CID 14775202

IUPAC3-amino-5-phenyl-1H-pyrazole-4-carboxamide
SMILESNC(=O)c1c(N)n[nH]c1-c1ccccc1
InChIInChI=1S/C10H10N4O/c11-9-7(10(12)15)8(13-14-9)6-4-2-1-3-5-6/h1-5H,(H2,12,15)(H3,11,13,14)
InChIKeyIKDWUDVONCJEGA-UHFFFAOYSA-N
MW202.22 g/mol
LogP0.76
Rot. Bonds2

About 3-amino-5-phenyl-1H-pyrazole-4-carboxamide

3-amino-5-phenyl-1H-pyrazole-4-carboxamide (PubChem CID 14775202) has the molecular formula C10H10N4O and a molecular weight of 202.22 g/mol. Its IUPAC name is 3-amino-5-phenyl-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound Name3-amino-5-phenyl-1H-pyrazole-4-carboxamide
PubChem CID14775202
Molecular FormulaC10H10N4O
Molecular Weight202.22 g/mol
Exact Mass202.09
IUPAC Name3-amino-5-phenyl-1H-pyrazole-4-carboxamide
SMILESNC(=O)c1c(N)n[nH]c1-c1ccccc1
InChIInChI=1S/C10H10N4O/c11-9-7(10(12)15)8(13-14-9)6-4-2-1-3-5-6/h1-5H,(H2,12,15)(H3,11,13,14)
InChIKeyIKDWUDVONCJEGA-UHFFFAOYSA-N
XLogP0.76
TPSA97.79 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.22
LogP ≤ 50.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-amino-5-phenyl-1H-pyrazole-4-carboxamide?
The IUPAC name of 3-amino-5-phenyl-1H-pyrazole-4-carboxamide (CID 14775202) is 3-amino-5-phenyl-1H-pyrazole-4-carboxamide.
What is the SMILES notation for 3-amino-5-phenyl-1H-pyrazole-4-carboxamide?
The canonical SMILES for 3-amino-5-phenyl-1H-pyrazole-4-carboxamide is NC(=O)c1c(N)n[nH]c1-c1ccccc1.
What is the InChIKey of 3-amino-5-phenyl-1H-pyrazole-4-carboxamide?
The InChIKey is IKDWUDVONCJEGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4O/c11-9-7(10(12)15)8(13-14-9)6-4-2-1-3-5-6/h1-5H,(H2,12,15)(H3,11,13,14).
What are the key properties of 3-amino-5-phenyl-1H-pyrazole-4-carboxamide?
3-amino-5-phenyl-1H-pyrazole-4-carboxamide has a molecular weight of 202.22 g/mol, XLogP of 0.76, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-5-phenyl-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 14775202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).