4-amino-1-ethylpyrazole-3-carboxamide

C6H10N4O — CID 6485352

IUPAC4-amino-1-ethylpyrazole-3-carboxamide
SMILESCCn1cc(N)c(C(N)=O)n1
InChIInChI=1S/C6H10N4O/c1-2-10-3-4(7)5(9-10)6(8)11/h3H,2,7H2,1H3,(H2,8,11)
InChIKeyKOKWBJQUPVMWDJ-UHFFFAOYSA-N
MW154.17 g/mol
LogP-0.42
Rot. Bonds2

About 4-amino-1-ethylpyrazole-3-carboxamide

4-amino-1-ethylpyrazole-3-carboxamide (PubChem CID 6485352) has the molecular formula C6H10N4O and a molecular weight of 154.17 g/mol. Its IUPAC name is 4-amino-1-ethylpyrazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-1-ethylpyrazole-3-carboxamide
PubChem CID6485352
Molecular FormulaC6H10N4O
Molecular Weight154.17 g/mol
Exact Mass154.09
IUPAC Name4-amino-1-ethylpyrazole-3-carboxamide
SMILESCCn1cc(N)c(C(N)=O)n1
InChIInChI=1S/C6H10N4O/c1-2-10-3-4(7)5(9-10)6(8)11/h3H,2,7H2,1H3,(H2,8,11)
InChIKeyKOKWBJQUPVMWDJ-UHFFFAOYSA-N
XLogP-0.42
TPSA86.93 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.17
LogP ≤ 5-0.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-amino-1-ethylpyrazole-3-carboxamide?
The IUPAC name of 4-amino-1-ethylpyrazole-3-carboxamide (CID 6485352) is 4-amino-1-ethylpyrazole-3-carboxamide.
What is the SMILES notation for 4-amino-1-ethylpyrazole-3-carboxamide?
The canonical SMILES for 4-amino-1-ethylpyrazole-3-carboxamide is CCn1cc(N)c(C(N)=O)n1.
What is the InChIKey of 4-amino-1-ethylpyrazole-3-carboxamide?
The InChIKey is KOKWBJQUPVMWDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N4O/c1-2-10-3-4(7)5(9-10)6(8)11/h3H,2,7H2,1H3,(H2,8,11).
What are the key properties of 4-amino-1-ethylpyrazole-3-carboxamide?
4-amino-1-ethylpyrazole-3-carboxamide has a molecular weight of 154.17 g/mol, XLogP of -0.42, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-ethylpyrazole-3-carboxamide is sourced from PubChem (CID 6485352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).