4-amino-1-(3-methyl-4-pyridinyl)pyrazole-3-carboxamide

C10H11N5O — CID 107346449

IUPAC4-amino-1-(3-methyl-4-pyridinyl)pyrazole-3-carboxamide
SMILESCc1cnccc1-n1cc(N)c(C(N)=O)n1
InChIInChI=1S/C10H11N5O/c1-6-4-13-3-2-8(6)15-5-7(11)9(14-15)10(12)16/h2-5H,11H2,1H3,(H2,12,16)
InChIKeyWCIJNEVNAVPOKL-UHFFFAOYSA-N
MW217.23 g/mol
LogP0.26
Rot. Bonds2

About 4-amino-1-(3-methyl-4-pyridinyl)pyrazole-3-carboxamide

4-amino-1-(3-methyl-4-pyridinyl)pyrazole-3-carboxamide (PubChem CID 107346449) has the molecular formula C10H11N5O and a molecular weight of 217.23 g/mol. Its IUPAC name is 4-amino-1-(3-methyl-4-pyridinyl)pyrazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-1-(3-methyl-4-pyridinyl)pyrazole-3-carboxamide
PubChem CID107346449
Molecular FormulaC10H11N5O
Molecular Weight217.23 g/mol
Exact Mass217.10
IUPAC Name4-amino-1-(3-methyl-4-pyridinyl)pyrazole-3-carboxamide
SMILESCc1cnccc1-n1cc(N)c(C(N)=O)n1
InChIInChI=1S/C10H11N5O/c1-6-4-13-3-2-8(6)15-5-7(11)9(14-15)10(12)16/h2-5H,11H2,1H3,(H2,12,16)
InChIKeyWCIJNEVNAVPOKL-UHFFFAOYSA-N
XLogP0.26
TPSA99.82 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.23
LogP ≤ 50.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-amino-1-(3-methyl-4-pyridinyl)pyrazole-3-carboxamide?
The IUPAC name of 4-amino-1-(3-methyl-4-pyridinyl)pyrazole-3-carboxamide (CID 107346449) is 4-amino-1-(3-methyl-4-pyridinyl)pyrazole-3-carboxamide.
What is the SMILES notation for 4-amino-1-(3-methyl-4-pyridinyl)pyrazole-3-carboxamide?
The canonical SMILES for 4-amino-1-(3-methyl-4-pyridinyl)pyrazole-3-carboxamide is Cc1cnccc1-n1cc(N)c(C(N)=O)n1.
What is the InChIKey of 4-amino-1-(3-methyl-4-pyridinyl)pyrazole-3-carboxamide?
The InChIKey is WCIJNEVNAVPOKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N5O/c1-6-4-13-3-2-8(6)15-5-7(11)9(14-15)10(12)16/h2-5H,11H2,1H3,(H2,12,16).
What are the key properties of 4-amino-1-(3-methyl-4-pyridinyl)pyrazole-3-carboxamide?
4-amino-1-(3-methyl-4-pyridinyl)pyrazole-3-carboxamide has a molecular weight of 217.23 g/mol, XLogP of 0.26, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-(3-methyl-4-pyridinyl)pyrazole-3-carboxamide is sourced from PubChem (CID 107346449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).