N,N-diethyl-5-[1-(4-propylphenyl)sulfonylpiperidin-4-yl]pyrazolo[1,5-a]pyridine-3-carboxamide

C26H34N4O3S — CID 50848703

IUPACN,N-diethyl-5-[1-(4-propylphenyl)sulfonylpiperidin-4-yl]pyrazolo[1,5-a]pyridine-3-carboxamide
SMILESCCCc1ccc(S(=O)(=O)N2CCC(c3ccn4ncc(C(=O)N(CC)CC)c4c3)CC2)cc1
InChIInChI=1S/C26H34N4O3S/c1-4-7-20-8-10-23(11-9-20)34(32,33)29-15-12-21(13-16-29)22-14-17-30-25(18-22)24(19-27-30)26(31)28(5-2)6-3/h8-11,14,17-19,21H,4-7,12-13,15-16H2,1-3H3
InChIKeyYLPPGLBMRGIQMV-UHFFFAOYSA-N
MW482.65 g/mol
LogP4.34
Rot. Bonds8

About N,N-diethyl-5-[1-(4-propylphenyl)sulfonylpiperidin-4-yl]pyrazolo[1,5-a]pyridine-3-carboxamide

N,N-diethyl-5-[1-(4-propylphenyl)sulfonylpiperidin-4-yl]pyrazolo[1,5-a]pyridine-3-carboxamide (PubChem CID 50848703) has the molecular formula C26H34N4O3S and a molecular weight of 482.65 g/mol. Its IUPAC name is N,N-diethyl-5-[1-(4-propylphenyl)sulfonylpiperidin-4-yl]pyrazolo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-5-[1-(4-propylphenyl)sulfonylpiperidin-4-yl]pyrazolo[1,5-a]pyridine-3-carboxamide
PubChem CID50848703
Molecular FormulaC26H34N4O3S
Molecular Weight482.65 g/mol
Exact Mass482.24
IUPAC NameN,N-diethyl-5-[1-(4-propylphenyl)sulfonylpiperidin-4-yl]pyrazolo[1,5-a]pyridine-3-carboxamide
SMILESCCCc1ccc(S(=O)(=O)N2CCC(c3ccn4ncc(C(=O)N(CC)CC)c4c3)CC2)cc1
InChIInChI=1S/C26H34N4O3S/c1-4-7-20-8-10-23(11-9-20)34(32,33)29-15-12-21(13-16-29)22-14-17-30-25(18-22)24(19-27-30)26(31)28(5-2)6-3/h8-11,14,17-19,21H,4-7,12-13,15-16H2,1-3H3
InChIKeyYLPPGLBMRGIQMV-UHFFFAOYSA-N
XLogP4.34
TPSA74.99 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500482.65
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-5-[1-(4-propylphenyl)sulfonylpiperidin-4-yl]pyrazolo[1,5-a]pyridine-3-carboxamide?
The IUPAC name of N,N-diethyl-5-[1-(4-propylphenyl)sulfonylpiperidin-4-yl]pyrazolo[1,5-a]pyridine-3-carboxamide (CID 50848703) is N,N-diethyl-5-[1-(4-propylphenyl)sulfonylpiperidin-4-yl]pyrazolo[1,5-a]pyridine-3-carboxamide.
What is the SMILES notation for N,N-diethyl-5-[1-(4-propylphenyl)sulfonylpiperidin-4-yl]pyrazolo[1,5-a]pyridine-3-carboxamide?
The canonical SMILES for N,N-diethyl-5-[1-(4-propylphenyl)sulfonylpiperidin-4-yl]pyrazolo[1,5-a]pyridine-3-carboxamide is CCCc1ccc(S(=O)(=O)N2CCC(c3ccn4ncc(C(=O)N(CC)CC)c4c3)CC2)cc1.
What is the InChIKey of N,N-diethyl-5-[1-(4-propylphenyl)sulfonylpiperidin-4-yl]pyrazolo[1,5-a]pyridine-3-carboxamide?
The InChIKey is YLPPGLBMRGIQMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H34N4O3S/c1-4-7-20-8-10-23(11-9-20)34(32,33)29-15-12-21(13-16-29)22-14-17-30-25(18-22)24(19-27-30)26(31)28(5-2)6-3/h8-11,14,17-19,21H,4-7,12-13,15-16H2,1-3H3.
What are the key properties of N,N-diethyl-5-[1-(4-propylphenyl)sulfonylpiperidin-4-yl]pyrazolo[1,5-a]pyridine-3-carboxamide?
N,N-diethyl-5-[1-(4-propylphenyl)sulfonylpiperidin-4-yl]pyrazolo[1,5-a]pyridine-3-carboxamide has a molecular weight of 482.65 g/mol, XLogP of 4.34, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-5-[1-(4-propylphenyl)sulfonylpiperidin-4-yl]pyrazolo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 50848703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).