2-chloro-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propanamide

C11H12ClN3O — CID 90538425

IUPAC2-chloro-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propanamide
SMILESCC(Cl)C(=O)NCc1cnn2ccccc12
InChIInChI=1S/C11H12ClN3O/c1-8(12)11(16)13-6-9-7-14-15-5-3-2-4-10(9)15/h2-5,7-8H,6H2,1H3,(H,13,16)
InChIKeyABBKEOIMPFJVKX-UHFFFAOYSA-N
MW237.69 g/mol
LogP1.58
Rot. Bonds3

About 2-chloro-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propanamide

2-chloro-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propanamide (PubChem CID 90538425) has the molecular formula C11H12ClN3O and a molecular weight of 237.69 g/mol. Its IUPAC name is 2-chloro-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propanamide.

Molecular Properties

Compound Name2-chloro-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propanamide
PubChem CID90538425
Molecular FormulaC11H12ClN3O
Molecular Weight237.69 g/mol
Exact Mass237.07
IUPAC Name2-chloro-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propanamide
SMILESCC(Cl)C(=O)NCc1cnn2ccccc12
InChIInChI=1S/C11H12ClN3O/c1-8(12)11(16)13-6-9-7-14-15-5-3-2-4-10(9)15/h2-5,7-8H,6H2,1H3,(H,13,16)
InChIKeyABBKEOIMPFJVKX-UHFFFAOYSA-N
XLogP1.58
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.69
LogP ≤ 51.58
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

2-(benzimidazol-1-yl)-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propanamide
CID 56915831
(2R)-2-(2-oxopyrrolidin-1-yl)-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propanamide
CID 95717558
4-chloro-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)benzamide
CID 90538445
N,N-dimethyl-2-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)propanamide
CID 63311793
1-(4-chlorophenyl)-3-(pyrazolo[1,5-a]pyridin-3-ylmethyl)urea
CID 90538547
2-chloro-N-[(2-hydroxyphenyl)methyl]propanamide
CID 82109945
3-methyl-3-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)butan-2-ol
CID 113342065
3-phenyl-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propanamide
CID 71790717
2-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)acetic acid
CID 63311880
3-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)propanamide
CID 63311707
1-(2-phenylethyl)-3-(pyrazolo[1,5-a]pyridin-3-ylmethyl)urea
CID 71790768
2-ethyl-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)aniline
CID 63312135

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propanamide?
The IUPAC name of 2-chloro-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propanamide (CID 90538425) is 2-chloro-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propanamide.
What is the SMILES notation for 2-chloro-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propanamide?
The canonical SMILES for 2-chloro-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propanamide is CC(Cl)C(=O)NCc1cnn2ccccc12.
What is the InChIKey of 2-chloro-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propanamide?
The InChIKey is ABBKEOIMPFJVKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12ClN3O/c1-8(12)11(16)13-6-9-7-14-15-5-3-2-4-10(9)15/h2-5,7-8H,6H2,1H3,(H,13,16).
What are the key properties of 2-chloro-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propanamide?
2-chloro-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propanamide has a molecular weight of 237.69 g/mol, XLogP of 1.58, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propanamide is sourced from PubChem (CID 90538425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).