tert-butyl 2-(3-ethylpyrazolo[5,4-c]pyridin-1-yl)acetate

C14H19N3O2 — CID 145446449

IUPACtert-butyl 2-(3-ethylpyrazolo[5,4-c]pyridin-1-yl)acetate
SMILESCCc1nn(CC(=O)OC(C)(C)C)c2cnccc12
InChIInChI=1S/C14H19N3O2/c1-5-11-10-6-7-15-8-12(10)17(16-11)9-13(18)19-14(2,3)4/h6-8H,5,9H2,1-4H3
InChIKeyCRLPUYZUBGBNIQ-UHFFFAOYSA-N
MW261.32 g/mol
LogP2.34
Rot. Bonds3

About tert-butyl 2-(3-ethylpyrazolo[5,4-c]pyridin-1-yl)acetate

tert-butyl 2-(3-ethylpyrazolo[5,4-c]pyridin-1-yl)acetate (PubChem CID 145446449) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is tert-butyl 2-(3-ethylpyrazolo[5,4-c]pyridin-1-yl)acetate.

Molecular Properties

Compound Nametert-butyl 2-(3-ethylpyrazolo[5,4-c]pyridin-1-yl)acetate
PubChem CID145446449
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC Nametert-butyl 2-(3-ethylpyrazolo[5,4-c]pyridin-1-yl)acetate
SMILESCCc1nn(CC(=O)OC(C)(C)C)c2cnccc12
InChIInChI=1S/C14H19N3O2/c1-5-11-10-6-7-15-8-12(10)17(16-11)9-13(18)19-14(2,3)4/h6-8H,5,9H2,1-4H3
InChIKeyCRLPUYZUBGBNIQ-UHFFFAOYSA-N
XLogP2.34
TPSA57.01 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze tert-butyl 2-(3-ethylpyrazolo[5,4-c]pyridin-1-yl)acetate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

tert-butyl 2-(3-ethyl-5-hydroxyindazol-1-yl)acetate
CID 123586260
methyl 2-(3-acetylpyrazolo[5,4-c]pyridin-1-yl)acetate
CID 118323423
tert-butyl 2-(3-amino-4,6,8,11-tetrazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaen-8-yl)acetate
CID 166517846
tert-butyl 2-[3-carbamoyl-5-(pyridin-3-ylamino)indazol-1-yl]acetate
CID 142420766
tert-butyl 2-pyrazolo[4,5-b]pyridin-1-ylacetate
CID 70817224
tert-butyl 2-(5-chloro-3-iodoindazol-1-yl)acetate
CID 129217032
tert-butyl 2-(3-amino-6-bromoindazol-1-yl)acetate
CID 155977865
tert-butyl 2-(3-cyano-6-hydroxyindazol-1-yl)acetate
CID 137147204
tert-butyl N-[(2S)-1-(3-ethyl-6-fluoroindazol-1-yl)propan-2-yl]carbamate
CID 54245996
tert-butyl 2-(5-phenyl-4-pyridin-4-yltriazol-1-yl)acetate
CID 134313439
acetyl 1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indazole-4-carboxylate
CID 151215829
benzyl 3-iodo-1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indazole-6-carboxylate
CID 135318077

Frequently Asked Questions

What is the IUPAC name of tert-butyl 2-(3-ethylpyrazolo[5,4-c]pyridin-1-yl)acetate?
The IUPAC name of tert-butyl 2-(3-ethylpyrazolo[5,4-c]pyridin-1-yl)acetate (CID 145446449) is tert-butyl 2-(3-ethylpyrazolo[5,4-c]pyridin-1-yl)acetate.
What is the SMILES notation for tert-butyl 2-(3-ethylpyrazolo[5,4-c]pyridin-1-yl)acetate?
The canonical SMILES for tert-butyl 2-(3-ethylpyrazolo[5,4-c]pyridin-1-yl)acetate is CCc1nn(CC(=O)OC(C)(C)C)c2cnccc12.
What is the InChIKey of tert-butyl 2-(3-ethylpyrazolo[5,4-c]pyridin-1-yl)acetate?
The InChIKey is CRLPUYZUBGBNIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c1-5-11-10-6-7-15-8-12(10)17(16-11)9-13(18)19-14(2,3)4/h6-8H,5,9H2,1-4H3.
What are the key properties of tert-butyl 2-(3-ethylpyrazolo[5,4-c]pyridin-1-yl)acetate?
tert-butyl 2-(3-ethylpyrazolo[5,4-c]pyridin-1-yl)acetate has a molecular weight of 261.32 g/mol, XLogP of 2.34, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl 2-(3-ethylpyrazolo[5,4-c]pyridin-1-yl)acetate is sourced from PubChem (CID 145446449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).