1,5-dimethyl-N-(5-methyl-1H-pyrazol-3-yl)pyrrole-2-carboxamide

C11H14N4O — CID 60518966

IUPAC1,5-dimethyl-N-(5-methyl-1H-pyrazol-3-yl)pyrrole-2-carboxamide
SMILESCc1cc(NC(=O)c2ccc(C)n2C)n[nH]1
InChIInChI=1S/C11H14N4O/c1-7-6-10(14-13-7)12-11(16)9-5-4-8(2)15(9)3/h4-6H,1-3H3,(H2,12,13,14,16)
InChIKeyAWPMIMXEYGRKNN-UHFFFAOYSA-N
MW218.26 g/mol
LogP1.62
Rot. Bonds2

About 1,5-dimethyl-N-(5-methyl-1H-pyrazol-3-yl)pyrrole-2-carboxamide

1,5-dimethyl-N-(5-methyl-1H-pyrazol-3-yl)pyrrole-2-carboxamide (PubChem CID 60518966) has the molecular formula C11H14N4O and a molecular weight of 218.26 g/mol. Its IUPAC name is 1,5-dimethyl-N-(5-methyl-1H-pyrazol-3-yl)pyrrole-2-carboxamide.

Molecular Properties

Compound Name1,5-dimethyl-N-(5-methyl-1H-pyrazol-3-yl)pyrrole-2-carboxamide
PubChem CID60518966
Molecular FormulaC11H14N4O
Molecular Weight218.26 g/mol
Exact Mass218.12
IUPAC Name1,5-dimethyl-N-(5-methyl-1H-pyrazol-3-yl)pyrrole-2-carboxamide
SMILESCc1cc(NC(=O)c2ccc(C)n2C)n[nH]1
InChIInChI=1S/C11H14N4O/c1-7-6-10(14-13-7)12-11(16)9-5-4-8(2)15(9)3/h4-6H,1-3H3,(H2,12,13,14,16)
InChIKeyAWPMIMXEYGRKNN-UHFFFAOYSA-N
XLogP1.62
TPSA62.71 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1,5-dimethyl-N-(5-methyl-1H-pyrazol-3-yl)pyrrole-2-carboxamide?
The IUPAC name of 1,5-dimethyl-N-(5-methyl-1H-pyrazol-3-yl)pyrrole-2-carboxamide (CID 60518966) is 1,5-dimethyl-N-(5-methyl-1H-pyrazol-3-yl)pyrrole-2-carboxamide.
What is the SMILES notation for 1,5-dimethyl-N-(5-methyl-1H-pyrazol-3-yl)pyrrole-2-carboxamide?
The canonical SMILES for 1,5-dimethyl-N-(5-methyl-1H-pyrazol-3-yl)pyrrole-2-carboxamide is Cc1cc(NC(=O)c2ccc(C)n2C)n[nH]1.
What is the InChIKey of 1,5-dimethyl-N-(5-methyl-1H-pyrazol-3-yl)pyrrole-2-carboxamide?
The InChIKey is AWPMIMXEYGRKNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O/c1-7-6-10(14-13-7)12-11(16)9-5-4-8(2)15(9)3/h4-6H,1-3H3,(H2,12,13,14,16).
What are the key properties of 1,5-dimethyl-N-(5-methyl-1H-pyrazol-3-yl)pyrrole-2-carboxamide?
1,5-dimethyl-N-(5-methyl-1H-pyrazol-3-yl)pyrrole-2-carboxamide has a molecular weight of 218.26 g/mol, XLogP of 1.62, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethyl-N-(5-methyl-1H-pyrazol-3-yl)pyrrole-2-carboxamide is sourced from PubChem (CID 60518966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).