2-[2-(diethylamino)ethylamino]-N-(5-methyl-1,3-thiazol-2-yl)acetamide

C12H22N4OS — CID 3229638

IUPAC2-[2-(diethylamino)ethylamino]-N-(5-methyl-1,3-thiazol-2-yl)acetamide
SMILESCCN(CC)CCNCC(=O)Nc1ncc(C)s1
InChIInChI=1S/C12H22N4OS/c1-4-16(5-2)7-6-13-9-11(17)15-12-14-8-10(3)18-12/h8,13H,4-7,9H2,1-3H3,(H,14,15,17)
InChIKeyUPOMTLGWCUTAFU-UHFFFAOYSA-N
MW270.40 g/mol
LogP1.32
Rot. Bonds8

About 2-[2-(diethylamino)ethylamino]-N-(5-methyl-1,3-thiazol-2-yl)acetamide

2-[2-(diethylamino)ethylamino]-N-(5-methyl-1,3-thiazol-2-yl)acetamide (PubChem CID 3229638) has the molecular formula C12H22N4OS and a molecular weight of 270.40 g/mol. Its IUPAC name is 2-[2-(diethylamino)ethylamino]-N-(5-methyl-1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-[2-(diethylamino)ethylamino]-N-(5-methyl-1,3-thiazol-2-yl)acetamide
PubChem CID3229638
Molecular FormulaC12H22N4OS
Molecular Weight270.40 g/mol
Exact Mass270.15
IUPAC Name2-[2-(diethylamino)ethylamino]-N-(5-methyl-1,3-thiazol-2-yl)acetamide
SMILESCCN(CC)CCNCC(=O)Nc1ncc(C)s1
InChIInChI=1S/C12H22N4OS/c1-4-16(5-2)7-6-13-9-11(17)15-12-14-8-10(3)18-12/h8,13H,4-7,9H2,1-3H3,(H,14,15,17)
InChIKeyUPOMTLGWCUTAFU-UHFFFAOYSA-N
XLogP1.32
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.40
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(5-Methyl-thiazol-2-yl)-2-piperidin-1-yl-acetamide
CID 23724323
N-[5-(1-piperidinylmethyl)-1,3-thiazol-2-yl]acetamide
CID 314318
O-ethyl [2-[(5-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]sulfanylmethanethioate
CID 1796567
N-(5-methyl-1,3-thiazol-2-yl)-2-piperidin-1-ylacetamide
CID 856406
2-(4-methylpiperazin-1-yl)-N-(5-methyl-1,3-thiazol-2-yl)propanamide;oxalic acid
CID 16195100
2-Acetamido-5-methylthiazole
CID 298507
2-(4-methylpiperazin-1-yl)-N-(5-methyl-1,3-thiazol-2-yl)propanamide
CID 3229459
2-methyl-1-(2-methylpropanoyl)-N-(5-methyl-1,3-thiazol-2-yl)azetidine-2-carboxamide
CID 49791145
2-(4-methylpiperazin-1-yl)-N-(5-methyl-1,3-thiazol-2-yl)acetamide
CID 66573013
2-(4-ethylpiperazin-1-yl)-N-(5-methyl-1,3-thiazol-2-yl)propanamide
CID 3229474
2-methyl-N-(5-methyl-1,3-thiazol-2-yl)-1-propanoylazetidine-2-carboxamide
CID 49791225
N-(5-cyanothiazol-2-yl)acetamide
CID 20544504

Frequently Asked Questions

What is the IUPAC name of 2-[2-(diethylamino)ethylamino]-N-(5-methyl-1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-[2-(diethylamino)ethylamino]-N-(5-methyl-1,3-thiazol-2-yl)acetamide (CID 3229638) is 2-[2-(diethylamino)ethylamino]-N-(5-methyl-1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-[2-(diethylamino)ethylamino]-N-(5-methyl-1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-[2-(diethylamino)ethylamino]-N-(5-methyl-1,3-thiazol-2-yl)acetamide is CCN(CC)CCNCC(=O)Nc1ncc(C)s1.
What is the InChIKey of 2-[2-(diethylamino)ethylamino]-N-(5-methyl-1,3-thiazol-2-yl)acetamide?
The InChIKey is UPOMTLGWCUTAFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4OS/c1-4-16(5-2)7-6-13-9-11(17)15-12-14-8-10(3)18-12/h8,13H,4-7,9H2,1-3H3,(H,14,15,17).
What are the key properties of 2-[2-(diethylamino)ethylamino]-N-(5-methyl-1,3-thiazol-2-yl)acetamide?
2-[2-(diethylamino)ethylamino]-N-(5-methyl-1,3-thiazol-2-yl)acetamide has a molecular weight of 270.40 g/mol, XLogP of 1.32, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(diethylamino)ethylamino]-N-(5-methyl-1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 3229638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).