4-butoxy-N-pyrazolo[1,5-a]pyridin-5-ylbenzamide

C18H19N3O2 — CID 86266822

IUPAC4-butoxy-N-pyrazolo[1,5-a]pyridin-5-ylbenzamide
SMILESCCCCOc1ccc(C(=O)Nc2ccn3nccc3c2)cc1
InChIInChI=1S/C18H19N3O2/c1-2-3-12-23-17-6-4-14(5-7-17)18(22)20-15-9-11-21-16(13-15)8-10-19-21/h4-11,13H,2-3,12H2,1H3,(H,20,22)
InChIKeyYVUFOJHRAPZZNI-UHFFFAOYSA-N
MW309.37 g/mol
LogP3.77
Rot. Bonds6

About 4-butoxy-N-pyrazolo[1,5-a]pyridin-5-ylbenzamide

4-butoxy-N-pyrazolo[1,5-a]pyridin-5-ylbenzamide (PubChem CID 86266822) has the molecular formula C18H19N3O2 and a molecular weight of 309.37 g/mol. Its IUPAC name is 4-butoxy-N-pyrazolo[1,5-a]pyridin-5-ylbenzamide.

Molecular Properties

Compound Name4-butoxy-N-pyrazolo[1,5-a]pyridin-5-ylbenzamide
PubChem CID86266822
Molecular FormulaC18H19N3O2
Molecular Weight309.37 g/mol
Exact Mass309.15
IUPAC Name4-butoxy-N-pyrazolo[1,5-a]pyridin-5-ylbenzamide
SMILESCCCCOc1ccc(C(=O)Nc2ccn3nccc3c2)cc1
InChIInChI=1S/C18H19N3O2/c1-2-3-12-23-17-6-4-14(5-7-17)18(22)20-15-9-11-21-16(13-15)8-10-19-21/h4-11,13H,2-3,12H2,1H3,(H,20,22)
InChIKeyYVUFOJHRAPZZNI-UHFFFAOYSA-N
XLogP3.77
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-butoxy-N-(2-pyrazol-1-ylpyrimidin-5-yl)benzamide
CID 71789781
4-butoxy-N-(2-chloro-4-pyridinyl)benzamide
CID 103606840
N-[3-(aminomethyl)phenyl]-4-butoxybenzamide
CID 24692929
N-[3-[(4-butoxybenzoyl)amino]phenyl]pyridine-3-carboxamide
CID 46547921
N-(1,3-benzothiazol-5-yl)-4-butoxybenzamide
CID 18585507
N-(4-benzamidophenyl)-4-butoxybenzamide
CID 17235408
4-butoxy-N-(3-hexoxyphenyl)benzamide
CID 17094812
N-(3-chlorophenyl)-4-pentoxybenzamide
CID 4934948
3-[(4-hexoxybenzoyl)amino]benzoic acid
CID 45425945
4-butoxy-N-[3-(hexanoylamino)phenyl]benzamide
CID 26161284
N-(3,4-dichlorophenyl)-4-hexoxybenzamide
CID 4933556
4-butoxy-N-[4-(2-phenylethoxy)phenyl]benzamide
CID 17066999

Frequently Asked Questions

What is the IUPAC name of 4-butoxy-N-pyrazolo[1,5-a]pyridin-5-ylbenzamide?
The IUPAC name of 4-butoxy-N-pyrazolo[1,5-a]pyridin-5-ylbenzamide (CID 86266822) is 4-butoxy-N-pyrazolo[1,5-a]pyridin-5-ylbenzamide.
What is the SMILES notation for 4-butoxy-N-pyrazolo[1,5-a]pyridin-5-ylbenzamide?
The canonical SMILES for 4-butoxy-N-pyrazolo[1,5-a]pyridin-5-ylbenzamide is CCCCOc1ccc(C(=O)Nc2ccn3nccc3c2)cc1.
What is the InChIKey of 4-butoxy-N-pyrazolo[1,5-a]pyridin-5-ylbenzamide?
The InChIKey is YVUFOJHRAPZZNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O2/c1-2-3-12-23-17-6-4-14(5-7-17)18(22)20-15-9-11-21-16(13-15)8-10-19-21/h4-11,13H,2-3,12H2,1H3,(H,20,22).
What are the key properties of 4-butoxy-N-pyrazolo[1,5-a]pyridin-5-ylbenzamide?
4-butoxy-N-pyrazolo[1,5-a]pyridin-5-ylbenzamide has a molecular weight of 309.37 g/mol, XLogP of 3.77, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-butoxy-N-pyrazolo[1,5-a]pyridin-5-ylbenzamide is sourced from PubChem (CID 86266822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).