6-ethyl-5-methyl-N-(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)-2-oxo-1H-pyridine-3-carboxamide

C16H20N4O2 — CID 167868911

IUPAC6-ethyl-5-methyl-N-(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)-2-oxo-1H-pyridine-3-carboxamide
SMILESCCc1[nH]c(=O)c(C(=O)Nc2c3c(nn2C)CCC3)cc1C
InChIInChI=1S/C16H20N4O2/c1-4-12-9(2)8-11(15(21)17-12)16(22)18-14-10-6-5-7-13(10)19-20(14)3/h8H,4-7H2,1-3H3,(H,17,21)(H,18,22)
InChIKeyGLLHUYBGPRBHJU-UHFFFAOYSA-N
MW300.36 g/mol
LogP1.72
Rot. Bonds3

About 6-ethyl-5-methyl-N-(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)-2-oxo-1H-pyridine-3-carboxamide

6-ethyl-5-methyl-N-(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 167868911) has the molecular formula C16H20N4O2 and a molecular weight of 300.36 g/mol. Its IUPAC name is 6-ethyl-5-methyl-N-(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name6-ethyl-5-methyl-N-(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)-2-oxo-1H-pyridine-3-carboxamide
PubChem CID167868911
Molecular FormulaC16H20N4O2
Molecular Weight300.36 g/mol
Exact Mass300.16
IUPAC Name6-ethyl-5-methyl-N-(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)-2-oxo-1H-pyridine-3-carboxamide
SMILESCCc1[nH]c(=O)c(C(=O)Nc2c3c(nn2C)CCC3)cc1C
InChIInChI=1S/C16H20N4O2/c1-4-12-9(2)8-11(15(21)17-12)16(22)18-14-10-6-5-7-13(10)19-20(14)3/h8H,4-7H2,1-3H3,(H,17,21)(H,18,22)
InChIKeyGLLHUYBGPRBHJU-UHFFFAOYSA-N
XLogP1.72
TPSA79.78 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 51.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-ethyl-5-methyl-N-(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of 6-ethyl-5-methyl-N-(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)-2-oxo-1H-pyridine-3-carboxamide (CID 167868911) is 6-ethyl-5-methyl-N-(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for 6-ethyl-5-methyl-N-(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for 6-ethyl-5-methyl-N-(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)-2-oxo-1H-pyridine-3-carboxamide is CCc1[nH]c(=O)c(C(=O)Nc2c3c(nn2C)CCC3)cc1C.
What is the InChIKey of 6-ethyl-5-methyl-N-(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is GLLHUYBGPRBHJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O2/c1-4-12-9(2)8-11(15(21)17-12)16(22)18-14-10-6-5-7-13(10)19-20(14)3/h8H,4-7H2,1-3H3,(H,17,21)(H,18,22).
What are the key properties of 6-ethyl-5-methyl-N-(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)-2-oxo-1H-pyridine-3-carboxamide?
6-ethyl-5-methyl-N-(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 300.36 g/mol, XLogP of 1.72, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-5-methyl-N-(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 167868911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).