N-(5-chloropentyl)pyrazolo[1,5-a]pyridine-3-carboxamide

C13H16ClN3O — CID 107320901

IUPACN-(5-chloropentyl)pyrazolo[1,5-a]pyridine-3-carboxamide
SMILESO=C(NCCCCCCl)c1cnn2ccccc12
InChIInChI=1S/C13H16ClN3O/c14-7-3-1-4-8-15-13(18)11-10-16-17-9-5-2-6-12(11)17/h2,5-6,9-10H,1,3-4,7-8H2,(H,15,18)
InChIKeyNBJKJHZVPSHPFP-UHFFFAOYSA-N
MW265.74 g/mol
LogP2.47
Rot. Bonds6

About N-(5-chloropentyl)pyrazolo[1,5-a]pyridine-3-carboxamide

N-(5-chloropentyl)pyrazolo[1,5-a]pyridine-3-carboxamide (PubChem CID 107320901) has the molecular formula C13H16ClN3O and a molecular weight of 265.74 g/mol. Its IUPAC name is N-(5-chloropentyl)pyrazolo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(5-chloropentyl)pyrazolo[1,5-a]pyridine-3-carboxamide
PubChem CID107320901
Molecular FormulaC13H16ClN3O
Molecular Weight265.74 g/mol
Exact Mass265.10
IUPAC NameN-(5-chloropentyl)pyrazolo[1,5-a]pyridine-3-carboxamide
SMILESO=C(NCCCCCCl)c1cnn2ccccc12
InChIInChI=1S/C13H16ClN3O/c14-7-3-1-4-8-15-13(18)11-10-16-17-9-5-2-6-12(11)17/h2,5-6,9-10H,1,3-4,7-8H2,(H,15,18)
InChIKeyNBJKJHZVPSHPFP-UHFFFAOYSA-N
XLogP2.47
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.74
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(3-cyanopropyl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 113412163
N-(4-chlorobutyl)pyrazolo[1,5-a]pyrazine-3-carboxamide
CID 106845452
N-(3-pyrrolidin-1-ylpropyl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 175830935
N-(4-bromopentyl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 114147488
N-[2-(ethylamino)ethyl]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 113265553
N-[3-(1H-imidazol-2-yl)propyl]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 103120564
N-[2-(propylamino)ethyl]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 113336480
2-hydroxy-4-(pyrazolo[1,5-a]pyridine-3-carbonylamino)butanoic acid
CID 114006253
N-(3-chloro-2-methylpropyl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 103122611
2-[2-(pyrazolo[1,5-a]pyridine-3-carbonylamino)ethylsulfanyl]acetic acid
CID 119241632
N-(2-methylprop-2-enyl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 104955628
N-[[2-(chloromethyl)cyclopentyl]methyl]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 103122654

Frequently Asked Questions

What is the IUPAC name of N-(5-chloropentyl)pyrazolo[1,5-a]pyridine-3-carboxamide?
The IUPAC name of N-(5-chloropentyl)pyrazolo[1,5-a]pyridine-3-carboxamide (CID 107320901) is N-(5-chloropentyl)pyrazolo[1,5-a]pyridine-3-carboxamide.
What is the SMILES notation for N-(5-chloropentyl)pyrazolo[1,5-a]pyridine-3-carboxamide?
The canonical SMILES for N-(5-chloropentyl)pyrazolo[1,5-a]pyridine-3-carboxamide is O=C(NCCCCCCl)c1cnn2ccccc12.
What is the InChIKey of N-(5-chloropentyl)pyrazolo[1,5-a]pyridine-3-carboxamide?
The InChIKey is NBJKJHZVPSHPFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16ClN3O/c14-7-3-1-4-8-15-13(18)11-10-16-17-9-5-2-6-12(11)17/h2,5-6,9-10H,1,3-4,7-8H2,(H,15,18).
What are the key properties of N-(5-chloropentyl)pyrazolo[1,5-a]pyridine-3-carboxamide?
N-(5-chloropentyl)pyrazolo[1,5-a]pyridine-3-carboxamide has a molecular weight of 265.74 g/mol, XLogP of 2.47, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloropentyl)pyrazolo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 107320901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).