1-methyl-5-pyrrol-1-ylpyrazole-4-carboxamide

C9H10N4O — CID 43244732

IUPAC1-methyl-5-pyrrol-1-ylpyrazole-4-carboxamide
SMILESCn1ncc(C(N)=O)c1-n1cccc1
InChIInChI=1S/C9H10N4O/c1-12-9(13-4-2-3-5-13)7(6-11-12)8(10)14/h2-6H,1H3,(H2,10,14)
InChIKeyZFTRGNMPJPXMSN-UHFFFAOYSA-N
MW190.21 g/mol
LogP0.31
Rot. Bonds2

About 1-methyl-5-pyrrol-1-ylpyrazole-4-carboxamide

1-methyl-5-pyrrol-1-ylpyrazole-4-carboxamide (PubChem CID 43244732) has the molecular formula C9H10N4O and a molecular weight of 190.21 g/mol. Its IUPAC name is 1-methyl-5-pyrrol-1-ylpyrazole-4-carboxamide.

Molecular Properties

Compound Name1-methyl-5-pyrrol-1-ylpyrazole-4-carboxamide
PubChem CID43244732
Molecular FormulaC9H10N4O
Molecular Weight190.21 g/mol
Exact Mass190.09
IUPAC Name1-methyl-5-pyrrol-1-ylpyrazole-4-carboxamide
SMILESCn1ncc(C(N)=O)c1-n1cccc1
InChIInChI=1S/C9H10N4O/c1-12-9(13-4-2-3-5-13)7(6-11-12)8(10)14/h2-6H,1H3,(H2,10,14)
InChIKeyZFTRGNMPJPXMSN-UHFFFAOYSA-N
XLogP0.31
TPSA65.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.21
LogP ≤ 50.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-5-pyrrol-1-ylpyrazole-4-carboxamide?
The IUPAC name of 1-methyl-5-pyrrol-1-ylpyrazole-4-carboxamide (CID 43244732) is 1-methyl-5-pyrrol-1-ylpyrazole-4-carboxamide.
What is the SMILES notation for 1-methyl-5-pyrrol-1-ylpyrazole-4-carboxamide?
The canonical SMILES for 1-methyl-5-pyrrol-1-ylpyrazole-4-carboxamide is Cn1ncc(C(N)=O)c1-n1cccc1.
What is the InChIKey of 1-methyl-5-pyrrol-1-ylpyrazole-4-carboxamide?
The InChIKey is ZFTRGNMPJPXMSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4O/c1-12-9(13-4-2-3-5-13)7(6-11-12)8(10)14/h2-6H,1H3,(H2,10,14).
What are the key properties of 1-methyl-5-pyrrol-1-ylpyrazole-4-carboxamide?
1-methyl-5-pyrrol-1-ylpyrazole-4-carboxamide has a molecular weight of 190.21 g/mol, XLogP of 0.31, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-5-pyrrol-1-ylpyrazole-4-carboxamide is sourced from PubChem (CID 43244732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).