2-amino-2-(1-methylpyrazol-4-yl)-N-[2-(1,3-thiazol-4-yl)ethyl]acetamide

C11H15N5OS — CID 115290732

IUPAC2-amino-2-(1-methylpyrazol-4-yl)-N-[2-(1,3-thiazol-4-yl)ethyl]acetamide
SMILESCn1cc(C(N)C(=O)NCCc2cscn2)cn1
InChIInChI=1S/C11H15N5OS/c1-16-5-8(4-15-16)10(12)11(17)13-3-2-9-6-18-7-14-9/h4-7,10H,2-3,12H2,1H3,(H,13,17)
InChIKeyHPALXWRFSTUCFL-UHFFFAOYSA-N
MW265.34 g/mol
LogP0.24
Rot. Bonds5

About 2-amino-2-(1-methylpyrazol-4-yl)-N-[2-(1,3-thiazol-4-yl)ethyl]acetamide

2-amino-2-(1-methylpyrazol-4-yl)-N-[2-(1,3-thiazol-4-yl)ethyl]acetamide (PubChem CID 115290732) has the molecular formula C11H15N5OS and a molecular weight of 265.34 g/mol. Its IUPAC name is 2-amino-2-(1-methylpyrazol-4-yl)-N-[2-(1,3-thiazol-4-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-amino-2-(1-methylpyrazol-4-yl)-N-[2-(1,3-thiazol-4-yl)ethyl]acetamide
PubChem CID115290732
Molecular FormulaC11H15N5OS
Molecular Weight265.34 g/mol
Exact Mass265.10
IUPAC Name2-amino-2-(1-methylpyrazol-4-yl)-N-[2-(1,3-thiazol-4-yl)ethyl]acetamide
SMILESCn1cc(C(N)C(=O)NCCc2cscn2)cn1
InChIInChI=1S/C11H15N5OS/c1-16-5-8(4-15-16)10(12)11(17)13-3-2-9-6-18-7-14-9/h4-7,10H,2-3,12H2,1H3,(H,13,17)
InChIKeyHPALXWRFSTUCFL-UHFFFAOYSA-N
XLogP0.24
TPSA85.83 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.34
LogP ≤ 50.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-amino-2-(1-methylpyrazol-4-yl)-N-(2-pyridin-2-ylethyl)acetamide
CID 115289665
N-(2-acetamidoethyl)-2-amino-2-(1-methylpyrazol-4-yl)acetamide
CID 113279811
2-amino-N-(3-aminopropyl)-2-(1-methylpyrazol-4-yl)acetamide
CID 115290433
2-amino-2-(1-methylpyrazol-4-yl)-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]acetamide
CID 114183640
2-[[2-amino-2-(1-methylpyrazol-4-yl)acetyl]amino]acetic acid
CID 115290299
2-amino-2-(1-methylpyrazol-4-yl)-N-(pyridin-2-ylmethyl)acetamide
CID 115289633
2-amino-N-[2-(cyclohexen-1-yl)ethyl]-2-(1-methylpyrazol-4-yl)acetamide
CID 115289768
2-amino-2-(1-methylpyrazol-4-yl)-N-(2-propan-2-yloxyethyl)acetamide
CID 104761168
2-amino-N-but-3-ynyl-2-(1-methylpyrazol-4-yl)acetamide
CID 115290756
5-[[2-amino-2-(1-methylpyrazol-4-yl)acetyl]amino]pentanamide
CID 114162023
2-amino-N-(3-ethoxypropyl)-2-(1-methylpyrazol-4-yl)acetamide
CID 115289645
6-[[2-amino-2-(1-methylpyrazol-4-yl)acetyl]amino]hexanoic acid
CID 115290306

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(1-methylpyrazol-4-yl)-N-[2-(1,3-thiazol-4-yl)ethyl]acetamide?
The IUPAC name of 2-amino-2-(1-methylpyrazol-4-yl)-N-[2-(1,3-thiazol-4-yl)ethyl]acetamide (CID 115290732) is 2-amino-2-(1-methylpyrazol-4-yl)-N-[2-(1,3-thiazol-4-yl)ethyl]acetamide.
What is the SMILES notation for 2-amino-2-(1-methylpyrazol-4-yl)-N-[2-(1,3-thiazol-4-yl)ethyl]acetamide?
The canonical SMILES for 2-amino-2-(1-methylpyrazol-4-yl)-N-[2-(1,3-thiazol-4-yl)ethyl]acetamide is Cn1cc(C(N)C(=O)NCCc2cscn2)cn1.
What is the InChIKey of 2-amino-2-(1-methylpyrazol-4-yl)-N-[2-(1,3-thiazol-4-yl)ethyl]acetamide?
The InChIKey is HPALXWRFSTUCFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5OS/c1-16-5-8(4-15-16)10(12)11(17)13-3-2-9-6-18-7-14-9/h4-7,10H,2-3,12H2,1H3,(H,13,17).
What are the key properties of 2-amino-2-(1-methylpyrazol-4-yl)-N-[2-(1,3-thiazol-4-yl)ethyl]acetamide?
2-amino-2-(1-methylpyrazol-4-yl)-N-[2-(1,3-thiazol-4-yl)ethyl]acetamide has a molecular weight of 265.34 g/mol, XLogP of 0.24, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-(1-methylpyrazol-4-yl)-N-[2-(1,3-thiazol-4-yl)ethyl]acetamide is sourced from PubChem (CID 115290732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).