1-(1,3-dimethylpyrazolo[5,4-c]pyridin-7-yl)-N-(2-morpholin-4-ylethyl)piperidine-4-carboxamide

C20H30N6O2 — CID 46396137

IUPAC1-(1,3-dimethylpyrazolo[5,4-c]pyridin-7-yl)-N-(2-morpholin-4-ylethyl)piperidine-4-carboxamide
SMILESCc1nn(C)c2c(N3CCC(C(=O)NCCN4CCOCC4)CC3)nccc12
InChIInChI=1S/C20H30N6O2/c1-15-17-3-6-21-19(18(17)24(2)23-15)26-8-4-16(5-9-26)20(27)22-7-10-25-11-13-28-14-12-25/h3,6,16H,4-5,7-14H2,1-2H3,(H,22,27)
InChIKeyFBPHTURSDHCVPQ-UHFFFAOYSA-N
MW386.50 g/mol
LogP0.94
Rot. Bonds5

About 1-(1,3-dimethylpyrazolo[5,4-c]pyridin-7-yl)-N-(2-morpholin-4-ylethyl)piperidine-4-carboxamide

1-(1,3-dimethylpyrazolo[5,4-c]pyridin-7-yl)-N-(2-morpholin-4-ylethyl)piperidine-4-carboxamide (PubChem CID 46396137) has the molecular formula C20H30N6O2 and a molecular weight of 386.50 g/mol. Its IUPAC name is 1-(1,3-dimethylpyrazolo[5,4-c]pyridin-7-yl)-N-(2-morpholin-4-ylethyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(1,3-dimethylpyrazolo[5,4-c]pyridin-7-yl)-N-(2-morpholin-4-ylethyl)piperidine-4-carboxamide
PubChem CID46396137
Molecular FormulaC20H30N6O2
Molecular Weight386.50 g/mol
Exact Mass386.24
IUPAC Name1-(1,3-dimethylpyrazolo[5,4-c]pyridin-7-yl)-N-(2-morpholin-4-ylethyl)piperidine-4-carboxamide
SMILESCc1nn(C)c2c(N3CCC(C(=O)NCCN4CCOCC4)CC3)nccc12
InChIInChI=1S/C20H30N6O2/c1-15-17-3-6-21-19(18(17)24(2)23-15)26-8-4-16(5-9-26)20(27)22-7-10-25-11-13-28-14-12-25/h3,6,16H,4-5,7-14H2,1-2H3,(H,22,27)
InChIKeyFBPHTURSDHCVPQ-UHFFFAOYSA-N
XLogP0.94
TPSA75.52 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.50
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 1-(1,3-dimethylpyrazolo[5,4-c]pyridin-7-yl)-N-(2-morpholin-4-ylethyl)piperidine-4-carboxamide?
The IUPAC name of 1-(1,3-dimethylpyrazolo[5,4-c]pyridin-7-yl)-N-(2-morpholin-4-ylethyl)piperidine-4-carboxamide (CID 46396137) is 1-(1,3-dimethylpyrazolo[5,4-c]pyridin-7-yl)-N-(2-morpholin-4-ylethyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(1,3-dimethylpyrazolo[5,4-c]pyridin-7-yl)-N-(2-morpholin-4-ylethyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(1,3-dimethylpyrazolo[5,4-c]pyridin-7-yl)-N-(2-morpholin-4-ylethyl)piperidine-4-carboxamide is Cc1nn(C)c2c(N3CCC(C(=O)NCCN4CCOCC4)CC3)nccc12.
What is the InChIKey of 1-(1,3-dimethylpyrazolo[5,4-c]pyridin-7-yl)-N-(2-morpholin-4-ylethyl)piperidine-4-carboxamide?
The InChIKey is FBPHTURSDHCVPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N6O2/c1-15-17-3-6-21-19(18(17)24(2)23-15)26-8-4-16(5-9-26)20(27)22-7-10-25-11-13-28-14-12-25/h3,6,16H,4-5,7-14H2,1-2H3,(H,22,27).
What are the key properties of 1-(1,3-dimethylpyrazolo[5,4-c]pyridin-7-yl)-N-(2-morpholin-4-ylethyl)piperidine-4-carboxamide?
1-(1,3-dimethylpyrazolo[5,4-c]pyridin-7-yl)-N-(2-morpholin-4-ylethyl)piperidine-4-carboxamide has a molecular weight of 386.50 g/mol, XLogP of 0.94, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,3-dimethylpyrazolo[5,4-c]pyridin-7-yl)-N-(2-morpholin-4-ylethyl)piperidine-4-carboxamide is sourced from PubChem (CID 46396137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).