N-cyclohexyl-1,3-dimethyl-4-oxo-7-propylpyrazolo[5,4-b]pyridine-5-carboxamide

C18H26N4O2 — CID 71562538

IUPACN-cyclohexyl-1,3-dimethyl-4-oxo-7-propylpyrazolo[5,4-b]pyridine-5-carboxamide
SMILESCCCn1cc(C(=O)NC2CCCCC2)c(=O)c2c(C)nn(C)c21
InChIInChI=1S/C18H26N4O2/c1-4-10-22-11-14(17(24)19-13-8-6-5-7-9-13)16(23)15-12(2)20-21(3)18(15)22/h11,13H,4-10H2,1-3H3,(H,19,24)
InChIKeyODPUKHOCHODROO-UHFFFAOYSA-N
MW330.43 g/mol
LogP2.52
Rot. Bonds4

About N-cyclohexyl-1,3-dimethyl-4-oxo-7-propylpyrazolo[5,4-b]pyridine-5-carboxamide

N-cyclohexyl-1,3-dimethyl-4-oxo-7-propylpyrazolo[5,4-b]pyridine-5-carboxamide (PubChem CID 71562538) has the molecular formula C18H26N4O2 and a molecular weight of 330.43 g/mol. Its IUPAC name is N-cyclohexyl-1,3-dimethyl-4-oxo-7-propylpyrazolo[5,4-b]pyridine-5-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-1,3-dimethyl-4-oxo-7-propylpyrazolo[5,4-b]pyridine-5-carboxamide
PubChem CID71562538
Molecular FormulaC18H26N4O2
Molecular Weight330.43 g/mol
Exact Mass330.21
IUPAC NameN-cyclohexyl-1,3-dimethyl-4-oxo-7-propylpyrazolo[5,4-b]pyridine-5-carboxamide
SMILESCCCn1cc(C(=O)NC2CCCCC2)c(=O)c2c(C)nn(C)c21
InChIInChI=1S/C18H26N4O2/c1-4-10-22-11-14(17(24)19-13-8-6-5-7-9-13)16(23)15-12(2)20-21(3)18(15)22/h11,13H,4-10H2,1-3H3,(H,19,24)
InChIKeyODPUKHOCHODROO-UHFFFAOYSA-N
XLogP2.52
TPSA68.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.43
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-1,3-dimethyl-4-oxo-7-propylpyrazolo[5,4-b]pyridine-5-carboxamide?
The IUPAC name of N-cyclohexyl-1,3-dimethyl-4-oxo-7-propylpyrazolo[5,4-b]pyridine-5-carboxamide (CID 71562538) is N-cyclohexyl-1,3-dimethyl-4-oxo-7-propylpyrazolo[5,4-b]pyridine-5-carboxamide.
What is the SMILES notation for N-cyclohexyl-1,3-dimethyl-4-oxo-7-propylpyrazolo[5,4-b]pyridine-5-carboxamide?
The canonical SMILES for N-cyclohexyl-1,3-dimethyl-4-oxo-7-propylpyrazolo[5,4-b]pyridine-5-carboxamide is CCCn1cc(C(=O)NC2CCCCC2)c(=O)c2c(C)nn(C)c21.
What is the InChIKey of N-cyclohexyl-1,3-dimethyl-4-oxo-7-propylpyrazolo[5,4-b]pyridine-5-carboxamide?
The InChIKey is ODPUKHOCHODROO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N4O2/c1-4-10-22-11-14(17(24)19-13-8-6-5-7-9-13)16(23)15-12(2)20-21(3)18(15)22/h11,13H,4-10H2,1-3H3,(H,19,24).
What are the key properties of N-cyclohexyl-1,3-dimethyl-4-oxo-7-propylpyrazolo[5,4-b]pyridine-5-carboxamide?
N-cyclohexyl-1,3-dimethyl-4-oxo-7-propylpyrazolo[5,4-b]pyridine-5-carboxamide has a molecular weight of 330.43 g/mol, XLogP of 2.52, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-1,3-dimethyl-4-oxo-7-propylpyrazolo[5,4-b]pyridine-5-carboxamide is sourced from PubChem (CID 71562538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).