N-(2-hydroxy-4-methylpentyl)-2-(6-methylimidazo[2,1-b][1,3]thiazol-3-yl)acetamide

C14H21N3O2S — CID 107155272

IUPACN-(2-hydroxy-4-methylpentyl)-2-(6-methylimidazo[2,1-b][1,3]thiazol-3-yl)acetamide
SMILESCc1cn2c(CC(=O)NCC(O)CC(C)C)csc2n1
InChIInChI=1S/C14H21N3O2S/c1-9(2)4-12(18)6-15-13(19)5-11-8-20-14-16-10(3)7-17(11)14/h7-9,12,18H,4-6H2,1-3H3,(H,15,19)
InChIKeyMATMOWRQCOBDLZ-UHFFFAOYSA-N
MW295.41 g/mol
LogP1.77
Rot. Bonds6

About N-(2-hydroxy-4-methylpentyl)-2-(6-methylimidazo[2,1-b][1,3]thiazol-3-yl)acetamide

N-(2-hydroxy-4-methylpentyl)-2-(6-methylimidazo[2,1-b][1,3]thiazol-3-yl)acetamide (PubChem CID 107155272) has the molecular formula C14H21N3O2S and a molecular weight of 295.41 g/mol. Its IUPAC name is N-(2-hydroxy-4-methylpentyl)-2-(6-methylimidazo[2,1-b][1,3]thiazol-3-yl)acetamide.

Molecular Properties

Compound NameN-(2-hydroxy-4-methylpentyl)-2-(6-methylimidazo[2,1-b][1,3]thiazol-3-yl)acetamide
PubChem CID107155272
Molecular FormulaC14H21N3O2S
Molecular Weight295.41 g/mol
Exact Mass295.14
IUPAC NameN-(2-hydroxy-4-methylpentyl)-2-(6-methylimidazo[2,1-b][1,3]thiazol-3-yl)acetamide
SMILESCc1cn2c(CC(=O)NCC(O)CC(C)C)csc2n1
InChIInChI=1S/C14H21N3O2S/c1-9(2)4-12(18)6-15-13(19)5-11-8-20-14-16-10(3)7-17(11)14/h7-9,12,18H,4-6H2,1-3H3,(H,15,19)
InChIKeyMATMOWRQCOBDLZ-UHFFFAOYSA-N
XLogP1.77
TPSA66.63 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.41
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-4-methylpentyl)-2-(6-methylimidazo[2,1-b][1,3]thiazol-3-yl)acetamide?
The IUPAC name of N-(2-hydroxy-4-methylpentyl)-2-(6-methylimidazo[2,1-b][1,3]thiazol-3-yl)acetamide (CID 107155272) is N-(2-hydroxy-4-methylpentyl)-2-(6-methylimidazo[2,1-b][1,3]thiazol-3-yl)acetamide.
What is the SMILES notation for N-(2-hydroxy-4-methylpentyl)-2-(6-methylimidazo[2,1-b][1,3]thiazol-3-yl)acetamide?
The canonical SMILES for N-(2-hydroxy-4-methylpentyl)-2-(6-methylimidazo[2,1-b][1,3]thiazol-3-yl)acetamide is Cc1cn2c(CC(=O)NCC(O)CC(C)C)csc2n1.
What is the InChIKey of N-(2-hydroxy-4-methylpentyl)-2-(6-methylimidazo[2,1-b][1,3]thiazol-3-yl)acetamide?
The InChIKey is MATMOWRQCOBDLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2S/c1-9(2)4-12(18)6-15-13(19)5-11-8-20-14-16-10(3)7-17(11)14/h7-9,12,18H,4-6H2,1-3H3,(H,15,19).
What are the key properties of N-(2-hydroxy-4-methylpentyl)-2-(6-methylimidazo[2,1-b][1,3]thiazol-3-yl)acetamide?
N-(2-hydroxy-4-methylpentyl)-2-(6-methylimidazo[2,1-b][1,3]thiazol-3-yl)acetamide has a molecular weight of 295.41 g/mol, XLogP of 1.77, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-4-methylpentyl)-2-(6-methylimidazo[2,1-b][1,3]thiazol-3-yl)acetamide is sourced from PubChem (CID 107155272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).