N-(4-amino-1-phenylpyrazol-3-yl)formamide

C10H10N4O — CID 87950545

IUPACN-(4-amino-1-phenylpyrazol-3-yl)formamide
SMILESNc1cn(-c2ccccc2)nc1NC=O
InChIInChI=1S/C10H10N4O/c11-9-6-14(13-10(9)12-7-15)8-4-2-1-3-5-8/h1-7H,11H2,(H,12,13,15)
InChIKeyRERUPOIYKWHBJD-UHFFFAOYSA-N
MW202.22 g/mol
LogP1.02
Rot. Bonds3

About N-(4-amino-1-phenylpyrazol-3-yl)formamide

N-(4-amino-1-phenylpyrazol-3-yl)formamide (PubChem CID 87950545) has the molecular formula C10H10N4O and a molecular weight of 202.22 g/mol. Its IUPAC name is N-(4-amino-1-phenylpyrazol-3-yl)formamide.

Molecular Properties

Compound NameN-(4-amino-1-phenylpyrazol-3-yl)formamide
PubChem CID87950545
Molecular FormulaC10H10N4O
Molecular Weight202.22 g/mol
Exact Mass202.09
IUPAC NameN-(4-amino-1-phenylpyrazol-3-yl)formamide
SMILESNc1cn(-c2ccccc2)nc1NC=O
InChIInChI=1S/C10H10N4O/c11-9-6-14(13-10(9)12-7-15)8-4-2-1-3-5-8/h1-7H,11H2,(H,12,13,15)
InChIKeyRERUPOIYKWHBJD-UHFFFAOYSA-N
XLogP1.02
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.22
LogP ≤ 51.02
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-(4-amino-1-phenylpyrazol-3-yl)formamide?
The IUPAC name of N-(4-amino-1-phenylpyrazol-3-yl)formamide (CID 87950545) is N-(4-amino-1-phenylpyrazol-3-yl)formamide.
What is the SMILES notation for N-(4-amino-1-phenylpyrazol-3-yl)formamide?
The canonical SMILES for N-(4-amino-1-phenylpyrazol-3-yl)formamide is Nc1cn(-c2ccccc2)nc1NC=O.
What is the InChIKey of N-(4-amino-1-phenylpyrazol-3-yl)formamide?
The InChIKey is RERUPOIYKWHBJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4O/c11-9-6-14(13-10(9)12-7-15)8-4-2-1-3-5-8/h1-7H,11H2,(H,12,13,15).
What are the key properties of N-(4-amino-1-phenylpyrazol-3-yl)formamide?
N-(4-amino-1-phenylpyrazol-3-yl)formamide has a molecular weight of 202.22 g/mol, XLogP of 1.02, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-amino-1-phenylpyrazol-3-yl)formamide is sourced from PubChem (CID 87950545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).