N-[(3S)-1-(thiophene-2-carbonyl)piperidin-3-yl]pyrazolo[1,5-a]pyridine-7-carboxamide

C18H18N4O2S — CID 95727351

IUPACN-[(3S)-1-(thiophene-2-carbonyl)piperidin-3-yl]pyrazolo[1,5-a]pyridine-7-carboxamide
SMILESO=C(N[C@H]1CCCN(C(=O)c2cccs2)C1)c1cccc2ccnn12
InChIInChI=1S/C18H18N4O2S/c23-17(15-6-1-5-14-8-9-19-22(14)15)20-13-4-2-10-21(12-13)18(24)16-7-3-11-25-16/h1,3,5-9,11,13H,2,4,10,12H2,(H,20,23)/t13-/m0/s1
InChIKeyUKXOGNGEPZCVBE-ZDUSSCGKSA-N
MW354.44 g/mol
LogP2.43
Rot. Bonds3

About N-[(3S)-1-(thiophene-2-carbonyl)piperidin-3-yl]pyrazolo[1,5-a]pyridine-7-carboxamide

N-[(3S)-1-(thiophene-2-carbonyl)piperidin-3-yl]pyrazolo[1,5-a]pyridine-7-carboxamide (PubChem CID 95727351) has the molecular formula C18H18N4O2S and a molecular weight of 354.44 g/mol. Its IUPAC name is N-[(3S)-1-(thiophene-2-carbonyl)piperidin-3-yl]pyrazolo[1,5-a]pyridine-7-carboxamide.

Molecular Properties

Compound NameN-[(3S)-1-(thiophene-2-carbonyl)piperidin-3-yl]pyrazolo[1,5-a]pyridine-7-carboxamide
PubChem CID95727351
Molecular FormulaC18H18N4O2S
Molecular Weight354.44 g/mol
Exact Mass354.12
IUPAC NameN-[(3S)-1-(thiophene-2-carbonyl)piperidin-3-yl]pyrazolo[1,5-a]pyridine-7-carboxamide
SMILESO=C(N[C@H]1CCCN(C(=O)c2cccs2)C1)c1cccc2ccnn12
InChIInChI=1S/C18H18N4O2S/c23-17(15-6-1-5-14-8-9-19-22(14)15)20-13-4-2-10-21(12-13)18(24)16-7-3-11-25-16/h1,3,5-9,11,13H,2,4,10,12H2,(H,20,23)/t13-/m0/s1
InChIKeyUKXOGNGEPZCVBE-ZDUSSCGKSA-N
XLogP2.43
TPSA66.71 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.44
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[(3S)-3-(methylamino)piperidin-1-yl]-thiophen-2-ylmethanone
CID 94475795
2-(ethylamino)-N-[(3S)-1-(thiophene-2-carbonyl)piperidin-3-yl]pyrimidine-5-carboxamide
CID 97122179
[3-(cyclopentylamino)piperidin-1-yl]-thiophen-2-ylmethanone
CID 83999954
2-(methylamino)-N-[(3S)-1-(thiophene-2-carbonyl)piperidin-3-yl]acetamide
CID 95401258
[3-(cyclopentylmethylamino)piperidin-1-yl]-thiophen-2-ylmethanone
CID 83997879
thiophen-2-yl-[3-([1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperidin-1-yl]methanone
CID 110214031
(3R)-1-(thiophene-2-carbonyl)piperidine-3-carboxylic acid
CID 858666
[3-(methylamino)pyrrolidin-1-yl]-thiophen-2-ylmethanone;hydrochloride
CID 119413673
N-[1-[1-(thiophene-2-carbonyl)piperidine-3-carbonyl]piperidin-4-yl]benzamide
CID 42892598
(3S)-N-propyl-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 39977852
[(3R)-3-phenylpiperidin-1-yl]-thiophen-2-ylmethanone
CID 740549
(3R)-N-pyridin-2-yl-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 30784713

Frequently Asked Questions

What is the IUPAC name of N-[(3S)-1-(thiophene-2-carbonyl)piperidin-3-yl]pyrazolo[1,5-a]pyridine-7-carboxamide?
The IUPAC name of N-[(3S)-1-(thiophene-2-carbonyl)piperidin-3-yl]pyrazolo[1,5-a]pyridine-7-carboxamide (CID 95727351) is N-[(3S)-1-(thiophene-2-carbonyl)piperidin-3-yl]pyrazolo[1,5-a]pyridine-7-carboxamide.
What is the SMILES notation for N-[(3S)-1-(thiophene-2-carbonyl)piperidin-3-yl]pyrazolo[1,5-a]pyridine-7-carboxamide?
The canonical SMILES for N-[(3S)-1-(thiophene-2-carbonyl)piperidin-3-yl]pyrazolo[1,5-a]pyridine-7-carboxamide is O=C(N[C@H]1CCCN(C(=O)c2cccs2)C1)c1cccc2ccnn12.
What is the InChIKey of N-[(3S)-1-(thiophene-2-carbonyl)piperidin-3-yl]pyrazolo[1,5-a]pyridine-7-carboxamide?
The InChIKey is UKXOGNGEPZCVBE-ZDUSSCGKSA-N. The full InChI is InChI=1S/C18H18N4O2S/c23-17(15-6-1-5-14-8-9-19-22(14)15)20-13-4-2-10-21(12-13)18(24)16-7-3-11-25-16/h1,3,5-9,11,13H,2,4,10,12H2,(H,20,23)/t13-/m0/s1.
What are the key properties of N-[(3S)-1-(thiophene-2-carbonyl)piperidin-3-yl]pyrazolo[1,5-a]pyridine-7-carboxamide?
N-[(3S)-1-(thiophene-2-carbonyl)piperidin-3-yl]pyrazolo[1,5-a]pyridine-7-carboxamide has a molecular weight of 354.44 g/mol, XLogP of 2.43, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3S)-1-(thiophene-2-carbonyl)piperidin-3-yl]pyrazolo[1,5-a]pyridine-7-carboxamide is sourced from PubChem (CID 95727351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).