1-ethyl-4-formamidopyrazole-3-carboxamide

C7H10N4O2 — CID 4777031

IUPAC1-ethyl-4-formamidopyrazole-3-carboxamide
SMILESCCn1cc(NC=O)c(C(N)=O)n1
InChIInChI=1S/C7H10N4O2/c1-2-11-3-5(9-4-12)6(10-11)7(8)13/h3-4H,2H2,1H3,(H2,8,13)(H,9,12)
InChIKeyZWUWBAUIALGWDR-UHFFFAOYSA-N
MW182.18 g/mol
LogP-0.43
Rot. Bonds4

About 1-ethyl-4-formamidopyrazole-3-carboxamide

1-ethyl-4-formamidopyrazole-3-carboxamide (PubChem CID 4777031) has the molecular formula C7H10N4O2 and a molecular weight of 182.18 g/mol. Its IUPAC name is 1-ethyl-4-formamidopyrazole-3-carboxamide.

Molecular Properties

Compound Name1-ethyl-4-formamidopyrazole-3-carboxamide
PubChem CID4777031
Molecular FormulaC7H10N4O2
Molecular Weight182.18 g/mol
Exact Mass182.08
IUPAC Name1-ethyl-4-formamidopyrazole-3-carboxamide
SMILESCCn1cc(NC=O)c(C(N)=O)n1
InChIInChI=1S/C7H10N4O2/c1-2-11-3-5(9-4-12)6(10-11)7(8)13/h3-4H,2H2,1H3,(H2,8,13)(H,9,12)
InChIKeyZWUWBAUIALGWDR-UHFFFAOYSA-N
XLogP-0.43
TPSA90.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.18
LogP ≤ 5-0.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-[[2-(4-chloro-3-methylpyrazol-1-yl)acetyl]amino]-1-ethylpyrazole-3-carboxamide
CID 4770289
1-ethyl-4-[(2-iodobenzoyl)amino]pyrazole-3-carboxamide
CID 19412436
4-[(3,4-dimethylbenzoyl)amino]-1-ethylpyrazole-3-carboxamide
CID 19412582
1-ethyl-4-[(1-ethyl-5-methylpyrazole-4-carbonyl)amino]pyrazole-3-carboxamide
CID 4772267
4-[[2-(4-chloro-5-methylpyrazol-1-yl)acetyl]amino]-1-ethylpyrazole-3-carboxamide
CID 19520691
trans-(1S,2S)-2-[(3-carbamoyl-1-ethylpyrazol-4-yl)carbamoyl]cyclohexane-1-carboxylic acid
CID 51851333
1-[4-(4-cyanophenyl)phenyl]-4-formamidopyrazole-3-carboxamide;methanamine
CID 143035580
4-[(2,4-dimethylphenyl)carbamothioylamino]-1-ethylpyrazole-3-carboxamide
CID 17283410
4-[(4-bromo-1-ethylpyrazole-5-carbonyl)amino]-1-ethylpyrazole-3-carboxamide
CID 4770344
4-[(4-chloro-1H-pyrazole-5-carbonyl)amino]-1-ethylpyrazole-3-carboxamide
CID 19479345
4-[(3,4-diethoxybenzoyl)amino]-1-ethylpyrazole-3-carboxamide
CID 19412447
1-ethyl-4-[3-(3-methyl-4-nitropyrazol-1-yl)propanoylamino]pyrazole-3-carboxamide
CID 19539887

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-4-formamidopyrazole-3-carboxamide?
The IUPAC name of 1-ethyl-4-formamidopyrazole-3-carboxamide (CID 4777031) is 1-ethyl-4-formamidopyrazole-3-carboxamide.
What is the SMILES notation for 1-ethyl-4-formamidopyrazole-3-carboxamide?
The canonical SMILES for 1-ethyl-4-formamidopyrazole-3-carboxamide is CCn1cc(NC=O)c(C(N)=O)n1.
What is the InChIKey of 1-ethyl-4-formamidopyrazole-3-carboxamide?
The InChIKey is ZWUWBAUIALGWDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N4O2/c1-2-11-3-5(9-4-12)6(10-11)7(8)13/h3-4H,2H2,1H3,(H2,8,13)(H,9,12).
What are the key properties of 1-ethyl-4-formamidopyrazole-3-carboxamide?
1-ethyl-4-formamidopyrazole-3-carboxamide has a molecular weight of 182.18 g/mol, XLogP of -0.43, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4-formamidopyrazole-3-carboxamide is sourced from PubChem (CID 4777031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).