6-cyclopropyl-N-[2-(diethylamino)-2-oxoethyl]-N-methyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide

C20H29N5O2 — CID 39947795

IUPAC6-cyclopropyl-N-[2-(diethylamino)-2-oxoethyl]-N-methyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCCN(CC)C(=O)CN(C)C(=O)c1cc(C2CC2)nc2c1cnn2C(C)C
InChIInChI=1S/C20H29N5O2/c1-6-24(7-2)18(26)12-23(5)20(27)15-10-17(14-8-9-14)22-19-16(15)11-21-25(19)13(3)4/h10-11,13-14H,6-9,12H2,1-5H3
InChIKeyOWFKWNJSHUNMBW-UHFFFAOYSA-N
MW371.49 g/mol
LogP2.83
Rot. Bonds7

About 6-cyclopropyl-N-[2-(diethylamino)-2-oxoethyl]-N-methyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide

6-cyclopropyl-N-[2-(diethylamino)-2-oxoethyl]-N-methyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide (PubChem CID 39947795) has the molecular formula C20H29N5O2 and a molecular weight of 371.49 g/mol. Its IUPAC name is 6-cyclopropyl-N-[2-(diethylamino)-2-oxoethyl]-N-methyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide.

Molecular Properties

Compound Name6-cyclopropyl-N-[2-(diethylamino)-2-oxoethyl]-N-methyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide
PubChem CID39947795
Molecular FormulaC20H29N5O2
Molecular Weight371.49 g/mol
Exact Mass371.23
IUPAC Name6-cyclopropyl-N-[2-(diethylamino)-2-oxoethyl]-N-methyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCCN(CC)C(=O)CN(C)C(=O)c1cc(C2CC2)nc2c1cnn2C(C)C
InChIInChI=1S/C20H29N5O2/c1-6-24(7-2)18(26)12-23(5)20(27)15-10-17(14-8-9-14)22-19-16(15)11-21-25(19)13(3)4/h10-11,13-14H,6-9,12H2,1-5H3
InChIKeyOWFKWNJSHUNMBW-UHFFFAOYSA-N
XLogP2.83
TPSA71.33 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.49
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-N-[2-(diethylamino)-2-oxoethyl]-N-methyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide?
The IUPAC name of 6-cyclopropyl-N-[2-(diethylamino)-2-oxoethyl]-N-methyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide (CID 39947795) is 6-cyclopropyl-N-[2-(diethylamino)-2-oxoethyl]-N-methyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide.
What is the SMILES notation for 6-cyclopropyl-N-[2-(diethylamino)-2-oxoethyl]-N-methyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide?
The canonical SMILES for 6-cyclopropyl-N-[2-(diethylamino)-2-oxoethyl]-N-methyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide is CCN(CC)C(=O)CN(C)C(=O)c1cc(C2CC2)nc2c1cnn2C(C)C.
What is the InChIKey of 6-cyclopropyl-N-[2-(diethylamino)-2-oxoethyl]-N-methyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide?
The InChIKey is OWFKWNJSHUNMBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H29N5O2/c1-6-24(7-2)18(26)12-23(5)20(27)15-10-17(14-8-9-14)22-19-16(15)11-21-25(19)13(3)4/h10-11,13-14H,6-9,12H2,1-5H3.
What are the key properties of 6-cyclopropyl-N-[2-(diethylamino)-2-oxoethyl]-N-methyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide?
6-cyclopropyl-N-[2-(diethylamino)-2-oxoethyl]-N-methyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide has a molecular weight of 371.49 g/mol, XLogP of 2.83, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-N-[2-(diethylamino)-2-oxoethyl]-N-methyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 39947795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).