2-phenyl-2-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)acetic acid

C16H15N3O2 — CID 63315133

IUPAC2-phenyl-2-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)acetic acid
SMILESO=C(O)C(NCc1cnn2ccccc12)c1ccccc1
InChIInChI=1S/C16H15N3O2/c20-16(21)15(12-6-2-1-3-7-12)17-10-13-11-18-19-9-5-4-8-14(13)19/h1-9,11,15,17H,10H2,(H,20,21)
InChIKeyUDEMBVLLVOHUOY-UHFFFAOYSA-N
MW281.31 g/mol
LogP2.25
Rot. Bonds5

About 2-phenyl-2-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)acetic acid

2-phenyl-2-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)acetic acid (PubChem CID 63315133) has the molecular formula C16H15N3O2 and a molecular weight of 281.31 g/mol. Its IUPAC name is 2-phenyl-2-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)acetic acid.

Molecular Properties

Compound Name2-phenyl-2-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)acetic acid
PubChem CID63315133
Molecular FormulaC16H15N3O2
Molecular Weight281.31 g/mol
Exact Mass281.12
IUPAC Name2-phenyl-2-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)acetic acid
SMILESO=C(O)C(NCc1cnn2ccccc12)c1ccccc1
InChIInChI=1S/C16H15N3O2/c20-16(21)15(12-6-2-1-3-7-12)17-10-13-11-18-19-9-5-4-8-14(13)19/h1-9,11,15,17H,10H2,(H,20,21)
InChIKeyUDEMBVLLVOHUOY-UHFFFAOYSA-N
XLogP2.25
TPSA66.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.31
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-1-phenyl-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propan-1-amine
CID 63311752
2-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)acetic acid
CID 63311880
N,N-dimethyl-2-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)propanamide
CID 63311793
2-chloro-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propanamide
CID 90538425
3-phenyl-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propanamide
CID 71790717
2-[(2-ethylphenyl)methylamino]-2-phenylacetic acid
CID 62392789
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
N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)-1,2-oxazole-5-carboxamide
CID 56886081
2-phenyl-2-[(1-propan-2-ylpyrazol-3-yl)methylamino]acetic acid
CID 64772221
3-methyl-3-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)butan-2-ol
CID 113342065
(1R)-1-(2-chlorophenyl)-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)ethanamine
CID 81376927

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-2-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)acetic acid?
The IUPAC name of 2-phenyl-2-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)acetic acid (CID 63315133) is 2-phenyl-2-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)acetic acid.
What is the SMILES notation for 2-phenyl-2-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)acetic acid?
The canonical SMILES for 2-phenyl-2-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)acetic acid is O=C(O)C(NCc1cnn2ccccc12)c1ccccc1.
What is the InChIKey of 2-phenyl-2-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)acetic acid?
The InChIKey is UDEMBVLLVOHUOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O2/c20-16(21)15(12-6-2-1-3-7-12)17-10-13-11-18-19-9-5-4-8-14(13)19/h1-9,11,15,17H,10H2,(H,20,21).
What are the key properties of 2-phenyl-2-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)acetic acid?
2-phenyl-2-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)acetic acid has a molecular weight of 281.31 g/mol, XLogP of 2.25, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-2-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)acetic acid is sourced from PubChem (CID 63315133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).