N-(3-chloro-2-methylpropyl)pyrazolo[1,5-a]pyridine-3-carboxamide

C12H14ClN3O — CID 103122611

IUPACN-(3-chloro-2-methylpropyl)pyrazolo[1,5-a]pyridine-3-carboxamide
SMILESCC(CCl)CNC(=O)c1cnn2ccccc12
InChIInChI=1S/C12H14ClN3O/c1-9(6-13)7-14-12(17)10-8-15-16-5-3-2-4-11(10)16/h2-5,8-9H,6-7H2,1H3,(H,14,17)
InChIKeyUTHRJPWECGVVGT-UHFFFAOYSA-N
MW251.72 g/mol
LogP1.94
Rot. Bonds4

About N-(3-chloro-2-methylpropyl)pyrazolo[1,5-a]pyridine-3-carboxamide

N-(3-chloro-2-methylpropyl)pyrazolo[1,5-a]pyridine-3-carboxamide (PubChem CID 103122611) has the molecular formula C12H14ClN3O and a molecular weight of 251.72 g/mol. Its IUPAC name is N-(3-chloro-2-methylpropyl)pyrazolo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-chloro-2-methylpropyl)pyrazolo[1,5-a]pyridine-3-carboxamide
PubChem CID103122611
Molecular FormulaC12H14ClN3O
Molecular Weight251.72 g/mol
Exact Mass251.08
IUPAC NameN-(3-chloro-2-methylpropyl)pyrazolo[1,5-a]pyridine-3-carboxamide
SMILESCC(CCl)CNC(=O)c1cnn2ccccc12
InChIInChI=1S/C12H14ClN3O/c1-9(6-13)7-14-12(17)10-8-15-16-5-3-2-4-11(10)16/h2-5,8-9H,6-7H2,1H3,(H,14,17)
InChIKeyUTHRJPWECGVVGT-UHFFFAOYSA-N
XLogP1.94
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.72
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[2-methyl-3-(methylamino)propyl]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 103806904
N-[2-(methylamino)propyl]pyrazolo[1,5-a]pyridine-3-carboxamide;hydrochloride
CID 120826687
N-(2-chloro-3-ethylpentyl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 106287553
N-(1-chloro-3-methylbutan-2-yl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 103122641
(2S)-2-hydroxy-3-(pyrazolo[1,5-a]pyridine-3-carbonylamino)propanoic acid
CID 107833160
N-(1-chloro-4-methylpentan-2-yl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 103122593
N-(2-bromo-3-methoxypropyl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 103122688
N-(5-chloropentyl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 107320901
N-(1-chloro-4-methylpentan-3-yl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 106354930
N-(4-bromopentyl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 114147488
N-(2-methylprop-2-enyl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 104955628
N-[2-(ethylamino)ethyl]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 113265553

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-2-methylpropyl)pyrazolo[1,5-a]pyridine-3-carboxamide?
The IUPAC name of N-(3-chloro-2-methylpropyl)pyrazolo[1,5-a]pyridine-3-carboxamide (CID 103122611) is N-(3-chloro-2-methylpropyl)pyrazolo[1,5-a]pyridine-3-carboxamide.
What is the SMILES notation for N-(3-chloro-2-methylpropyl)pyrazolo[1,5-a]pyridine-3-carboxamide?
The canonical SMILES for N-(3-chloro-2-methylpropyl)pyrazolo[1,5-a]pyridine-3-carboxamide is CC(CCl)CNC(=O)c1cnn2ccccc12.
What is the InChIKey of N-(3-chloro-2-methylpropyl)pyrazolo[1,5-a]pyridine-3-carboxamide?
The InChIKey is UTHRJPWECGVVGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14ClN3O/c1-9(6-13)7-14-12(17)10-8-15-16-5-3-2-4-11(10)16/h2-5,8-9H,6-7H2,1H3,(H,14,17).
What are the key properties of N-(3-chloro-2-methylpropyl)pyrazolo[1,5-a]pyridine-3-carboxamide?
N-(3-chloro-2-methylpropyl)pyrazolo[1,5-a]pyridine-3-carboxamide has a molecular weight of 251.72 g/mol, XLogP of 1.94, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-2-methylpropyl)pyrazolo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 103122611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).