3-methyl-3-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)butan-2-ol

C13H19N3O — CID 113342065

IUPAC3-methyl-3-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)butan-2-ol
SMILESCC(O)C(C)(C)NCc1cnn2ccccc12
InChIInChI=1S/C13H19N3O/c1-10(17)13(2,3)14-8-11-9-15-16-7-5-4-6-12(11)16/h4-7,9-10,14,17H,8H2,1-3H3
InChIKeyBNVZXCHUISRTBI-UHFFFAOYSA-N
MW233.31 g/mol
LogP1.58
Rot. Bonds4

About 3-methyl-3-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)butan-2-ol

3-methyl-3-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)butan-2-ol (PubChem CID 113342065) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is 3-methyl-3-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)butan-2-ol.

Molecular Properties

Compound Name3-methyl-3-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)butan-2-ol
PubChem CID113342065
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC Name3-methyl-3-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)butan-2-ol
SMILESCC(O)C(C)(C)NCc1cnn2ccccc12
InChIInChI=1S/C13H19N3O/c1-10(17)13(2,3)14-8-11-9-15-16-7-5-4-6-12(11)16/h4-7,9-10,14,17H,8H2,1-3H3
InChIKeyBNVZXCHUISRTBI-UHFFFAOYSA-N
XLogP1.58
TPSA49.56 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-bromophenyl)-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propan-2-amine
CID 63315474
2-chloro-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propanamide
CID 90538425
3-(2,2-dimethylpropyl)pyrazolo[1,5-a]pyridine
CID 135157716
tert-butyl N-[(2R)-2,4-dimethyl-2-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)pentyl]carbamate
CID 97013434
2-(benzimidazol-1-yl)-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propanamide
CID 56915831
2-methylsulfanyl-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propan-1-amine
CID 115757570
2-methyl-1-phenyl-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propan-1-amine
CID 63311752
N,N-dimethyl-2-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)propanamide
CID 63311793
2-ethyl-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)aniline
CID 63312135
2-methyl-3-methylsulfanyl-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propan-1-amine
CID 63965507
(1R)-1-(2-chlorophenyl)-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)ethanamine
CID 81376927
2-fluoro-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)aniline
CID 63311958

Frequently Asked Questions

What is the IUPAC name of 3-methyl-3-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)butan-2-ol?
The IUPAC name of 3-methyl-3-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)butan-2-ol (CID 113342065) is 3-methyl-3-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)butan-2-ol.
What is the SMILES notation for 3-methyl-3-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)butan-2-ol?
The canonical SMILES for 3-methyl-3-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)butan-2-ol is CC(O)C(C)(C)NCc1cnn2ccccc12.
What is the InChIKey of 3-methyl-3-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)butan-2-ol?
The InChIKey is BNVZXCHUISRTBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c1-10(17)13(2,3)14-8-11-9-15-16-7-5-4-6-12(11)16/h4-7,9-10,14,17H,8H2,1-3H3.
What are the key properties of 3-methyl-3-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)butan-2-ol?
3-methyl-3-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)butan-2-ol has a molecular weight of 233.31 g/mol, XLogP of 1.58, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-3-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)butan-2-ol is sourced from PubChem (CID 113342065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).