2-[4-(1-thieno[3,2-b]pyridin-6-ylethylamino)pyrazol-1-yl]acetamide

C14H15N5OS — CID 64828610

IUPAC2-[4-(1-thieno[3,2-b]pyridin-6-ylethylamino)pyrazol-1-yl]acetamide
SMILESCC(Nc1cnn(CC(N)=O)c1)c1cnc2ccsc2c1
InChIInChI=1S/C14H15N5OS/c1-9(10-4-13-12(16-5-10)2-3-21-13)18-11-6-17-19(7-11)8-14(15)20/h2-7,9,18H,8H2,1H3,(H2,15,20)
InChIKeySKIOXAAUPOIDTQ-UHFFFAOYSA-N
MW301.38 g/mol
LogP2.15
Rot. Bonds5

About 2-[4-(1-thieno[3,2-b]pyridin-6-ylethylamino)pyrazol-1-yl]acetamide

2-[4-(1-thieno[3,2-b]pyridin-6-ylethylamino)pyrazol-1-yl]acetamide (PubChem CID 64828610) has the molecular formula C14H15N5OS and a molecular weight of 301.38 g/mol. Its IUPAC name is 2-[4-(1-thieno[3,2-b]pyridin-6-ylethylamino)pyrazol-1-yl]acetamide.

Molecular Properties

Compound Name2-[4-(1-thieno[3,2-b]pyridin-6-ylethylamino)pyrazol-1-yl]acetamide
PubChem CID64828610
Molecular FormulaC14H15N5OS
Molecular Weight301.38 g/mol
Exact Mass301.10
IUPAC Name2-[4-(1-thieno[3,2-b]pyridin-6-ylethylamino)pyrazol-1-yl]acetamide
SMILESCC(Nc1cnn(CC(N)=O)c1)c1cnc2ccsc2c1
InChIInChI=1S/C14H15N5OS/c1-9(10-4-13-12(16-5-10)2-3-21-13)18-11-6-17-19(7-11)8-14(15)20/h2-7,9,18H,8H2,1H3,(H2,15,20)
InChIKeySKIOXAAUPOIDTQ-UHFFFAOYSA-N
XLogP2.15
TPSA85.83 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.38
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

US9586948, Example 22
CID 117872182
US10377753, Example 130
CID 124175977
N,N-dimethyl-2-[6-(4-methylthiophen-2-yl)pyrrolo[3,2-b]pyridin-1-yl]acetamide
CID 124175991
US10377753, Example 386
CID 124176242
N-[5-[4-(1-ethylpyrazol-4-yl)thiophen-2-yl]-3-pyridinyl]cyclopropanecarboxamide
CID 145981774
N-[5-[4-(1-methylpyrazol-4-yl)thiophen-2-yl]-3-pyridinyl]cyclopropanecarboxamide
CID 145989404
N-[5-[4-(1-propylpyrazol-4-yl)thiophen-2-yl]-3-pyridinyl]cyclopropanecarboxamide
CID 145991360
N-(2-fluorophenyl)-2-[3-(6-methyl-2-pyridinyl)-4-thieno[3,2-c]pyridin-2-ylpyrazol-1-yl]acetamide
CID 155528043
N-(3-fluorophenyl)-2-[3-(6-methyl-2-pyridinyl)-4-thieno[3,2-c]pyridin-2-ylpyrazol-1-yl]acetamide
CID 155541940
N-(3-cyanophenyl)-2-[3-(6-methyl-2-pyridinyl)-4-thieno[3,2-c]pyridin-2-ylpyrazol-1-yl]acetamide
CID 155546431
2-[3-(6-methyl-2-pyridinyl)-4-thieno[3,2-c]pyridin-2-ylpyrazol-1-yl]-N-phenylacetamide
CID 155553747
3-[2-(3,5-dimethylpyrazol-1-yl)ethylamino]-N-[3-([1,3]thiazolo[4,5-c]pyridin-2-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl]propanamide
CID 124120423

Frequently Asked Questions

What is the IUPAC name of 2-[4-(1-thieno[3,2-b]pyridin-6-ylethylamino)pyrazol-1-yl]acetamide?
The IUPAC name of 2-[4-(1-thieno[3,2-b]pyridin-6-ylethylamino)pyrazol-1-yl]acetamide (CID 64828610) is 2-[4-(1-thieno[3,2-b]pyridin-6-ylethylamino)pyrazol-1-yl]acetamide.
What is the SMILES notation for 2-[4-(1-thieno[3,2-b]pyridin-6-ylethylamino)pyrazol-1-yl]acetamide?
The canonical SMILES for 2-[4-(1-thieno[3,2-b]pyridin-6-ylethylamino)pyrazol-1-yl]acetamide is CC(Nc1cnn(CC(N)=O)c1)c1cnc2ccsc2c1.
What is the InChIKey of 2-[4-(1-thieno[3,2-b]pyridin-6-ylethylamino)pyrazol-1-yl]acetamide?
The InChIKey is SKIOXAAUPOIDTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N5OS/c1-9(10-4-13-12(16-5-10)2-3-21-13)18-11-6-17-19(7-11)8-14(15)20/h2-7,9,18H,8H2,1H3,(H2,15,20).
What are the key properties of 2-[4-(1-thieno[3,2-b]pyridin-6-ylethylamino)pyrazol-1-yl]acetamide?
2-[4-(1-thieno[3,2-b]pyridin-6-ylethylamino)pyrazol-1-yl]acetamide has a molecular weight of 301.38 g/mol, XLogP of 2.15, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(1-thieno[3,2-b]pyridin-6-ylethylamino)pyrazol-1-yl]acetamide is sourced from PubChem (CID 64828610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).