N-methyl-1-[(3S)-1-(pyrazolo[1,5-a]pyridin-3-ylmethyl)piperidin-3-yl]pyrazole-3-carboxamide

C18H22N6O — CID 129475944

IUPACN-methyl-1-[(3S)-1-(pyrazolo[1,5-a]pyridin-3-ylmethyl)piperidin-3-yl]pyrazole-3-carboxamide
SMILESCNC(=O)c1ccn([C@H]2CCCN(Cc3cnn4ccccc34)C2)n1
InChIInChI=1S/C18H22N6O/c1-19-18(25)16-7-10-23(21-16)15-5-4-8-22(13-15)12-14-11-20-24-9-3-2-6-17(14)24/h2-3,6-7,9-11,15H,4-5,8,12-13H2,1H3,(H,19,25)/t15-/m0/s1
InChIKeyXJEOHOIDWDPCJF-HNNXBMFYSA-N
MW338.42 g/mol
LogP1.73
Rot. Bonds4

About N-methyl-1-[(3S)-1-(pyrazolo[1,5-a]pyridin-3-ylmethyl)piperidin-3-yl]pyrazole-3-carboxamide

N-methyl-1-[(3S)-1-(pyrazolo[1,5-a]pyridin-3-ylmethyl)piperidin-3-yl]pyrazole-3-carboxamide (PubChem CID 129475944) has the molecular formula C18H22N6O and a molecular weight of 338.42 g/mol. Its IUPAC name is N-methyl-1-[(3S)-1-(pyrazolo[1,5-a]pyridin-3-ylmethyl)piperidin-3-yl]pyrazole-3-carboxamide.

Molecular Properties

Compound NameN-methyl-1-[(3S)-1-(pyrazolo[1,5-a]pyridin-3-ylmethyl)piperidin-3-yl]pyrazole-3-carboxamide
PubChem CID129475944
Molecular FormulaC18H22N6O
Molecular Weight338.42 g/mol
Exact Mass338.19
IUPAC NameN-methyl-1-[(3S)-1-(pyrazolo[1,5-a]pyridin-3-ylmethyl)piperidin-3-yl]pyrazole-3-carboxamide
SMILESCNC(=O)c1ccn([C@H]2CCCN(Cc3cnn4ccccc34)C2)n1
InChIInChI=1S/C18H22N6O/c1-19-18(25)16-7-10-23(21-16)15-5-4-8-22(13-15)12-14-11-20-24-9-3-2-6-17(14)24/h2-3,6-7,9-11,15H,4-5,8,12-13H2,1H3,(H,19,25)/t15-/m0/s1
InChIKeyXJEOHOIDWDPCJF-HNNXBMFYSA-N
XLogP1.73
TPSA67.46 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.42
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-methyl-1-[(3S)-1-(pyrazolo[1,5-a]pyridin-3-ylmethyl)piperidin-3-yl]pyrazole-3-carboxamide with MolForge

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Related Compounds

1-[1-[[5-(hydroxymethyl)furan-2-yl]methyl]piperidin-3-yl]-N-methylpyrazole-3-carboxamide
CID 128976151
1-[(3R)-1-(imidazo[1,2-a]pyrimidin-3-ylmethyl)piperidin-3-yl]-N-methylpyrazole-3-carboxamide
CID 129332274
N-methyl-1-[(3S)-1-[(2-methyl-1-benzofuran-3-yl)methyl]piperidin-3-yl]pyrazole-3-carboxamide
CID 129344407
1-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]piperidin-3-yl]-N-methylpyrazole-3-carboxamide
CID 128976121
1-[1-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]piperidin-3-yl]-N-methylpyrazole-3-carboxamide
CID 128976111
1-[(3S)-1-(2-cycloheptylethyl)piperidin-3-yl]-N-methylpyrazole-3-carboxamide
CID 100626552
N-methyl-1-[1-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethyl]piperidin-3-yl]pyrazole-3-carboxamide
CID 127975200
1-[1-[2-(2-fluorophenyl)-2-hydroxyethyl]piperidin-3-yl]-N-methylpyrazole-3-carboxamide
CID 128976142
N-methyl-1-[1-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]piperidin-3-yl]pyrazole-3-carboxamide
CID 128976100
1-[(3S)-1-[(4-ethyl-6-oxo-1H-pyrimidin-2-yl)methyl]piperidin-3-yl]-N-methylpyrazole-3-carboxamide
CID 137204395
N-methyl-1-[(3R)-1-[2-oxo-2-(pyridin-3-ylmethylamino)ethyl]piperidin-3-yl]pyrazole-3-carboxamide
CID 129477222
1-[1-(1,3-benzothiazol-2-yl)piperidin-3-yl]-N-methylpyrazole-3-carboxamide
CID 128977516

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[(3S)-1-(pyrazolo[1,5-a]pyridin-3-ylmethyl)piperidin-3-yl]pyrazole-3-carboxamide?
The IUPAC name of N-methyl-1-[(3S)-1-(pyrazolo[1,5-a]pyridin-3-ylmethyl)piperidin-3-yl]pyrazole-3-carboxamide (CID 129475944) is N-methyl-1-[(3S)-1-(pyrazolo[1,5-a]pyridin-3-ylmethyl)piperidin-3-yl]pyrazole-3-carboxamide.
What is the SMILES notation for N-methyl-1-[(3S)-1-(pyrazolo[1,5-a]pyridin-3-ylmethyl)piperidin-3-yl]pyrazole-3-carboxamide?
The canonical SMILES for N-methyl-1-[(3S)-1-(pyrazolo[1,5-a]pyridin-3-ylmethyl)piperidin-3-yl]pyrazole-3-carboxamide is CNC(=O)c1ccn([C@H]2CCCN(Cc3cnn4ccccc34)C2)n1.
What is the InChIKey of N-methyl-1-[(3S)-1-(pyrazolo[1,5-a]pyridin-3-ylmethyl)piperidin-3-yl]pyrazole-3-carboxamide?
The InChIKey is XJEOHOIDWDPCJF-HNNXBMFYSA-N. The full InChI is InChI=1S/C18H22N6O/c1-19-18(25)16-7-10-23(21-16)15-5-4-8-22(13-15)12-14-11-20-24-9-3-2-6-17(14)24/h2-3,6-7,9-11,15H,4-5,8,12-13H2,1H3,(H,19,25)/t15-/m0/s1.
What are the key properties of N-methyl-1-[(3S)-1-(pyrazolo[1,5-a]pyridin-3-ylmethyl)piperidin-3-yl]pyrazole-3-carboxamide?
N-methyl-1-[(3S)-1-(pyrazolo[1,5-a]pyridin-3-ylmethyl)piperidin-3-yl]pyrazole-3-carboxamide has a molecular weight of 338.42 g/mol, XLogP of 1.73, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[(3S)-1-(pyrazolo[1,5-a]pyridin-3-ylmethyl)piperidin-3-yl]pyrazole-3-carboxamide is sourced from PubChem (CID 129475944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).