N-cyclobutyl-N-(3-hydroxypropyl)-1,3-thiazole-4-carboxamide

C11H16N2O2S — CID 102862752

IUPACN-cyclobutyl-N-(3-hydroxypropyl)-1,3-thiazole-4-carboxamide
SMILESO=C(c1cscn1)N(CCCO)C1CCC1
InChIInChI=1S/C11H16N2O2S/c14-6-2-5-13(9-3-1-4-9)11(15)10-7-16-8-12-10/h7-9,14H,1-6H2
InChIKeyGMVIGLBBFAQTHW-UHFFFAOYSA-N
MW240.33 g/mol
LogP1.52
Rot. Bonds5

About N-cyclobutyl-N-(3-hydroxypropyl)-1,3-thiazole-4-carboxamide

N-cyclobutyl-N-(3-hydroxypropyl)-1,3-thiazole-4-carboxamide (PubChem CID 102862752) has the molecular formula C11H16N2O2S and a molecular weight of 240.33 g/mol. Its IUPAC name is N-cyclobutyl-N-(3-hydroxypropyl)-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound NameN-cyclobutyl-N-(3-hydroxypropyl)-1,3-thiazole-4-carboxamide
PubChem CID102862752
Molecular FormulaC11H16N2O2S
Molecular Weight240.33 g/mol
Exact Mass240.09
IUPAC NameN-cyclobutyl-N-(3-hydroxypropyl)-1,3-thiazole-4-carboxamide
SMILESO=C(c1cscn1)N(CCCO)C1CCC1
InChIInChI=1S/C11H16N2O2S/c14-6-2-5-13(9-3-1-4-9)11(15)10-7-16-8-12-10/h7-9,14H,1-6H2
InChIKeyGMVIGLBBFAQTHW-UHFFFAOYSA-N
XLogP1.52
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.33
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclobutyl-N-(2-hydroxyethyl)-1,3-thiazole-4-carboxamide
CID 102684545
N-cyclopentyl-N-ethyl-1,3-thiazole-4-carboxamide
CID 63037041
3-[cyclopropyl(1,3-thiazole-4-carbonyl)amino]propanoic acid
CID 63024405
N-cyclobutyl-N-(3-hydroxypropyl)thiophene-3-carboxamide
CID 102866076
4-chloro-N-cyclobutyl-N-(3-hydroxypropyl)pyridine-2-carboxamide
CID 102861506
N-butyl-N-(1,1-dioxothiolan-3-yl)-1,3-thiazole-4-carboxamide
CID 62046166
N-cyclobutyl-5-cyclopropyl-N-(3-hydroxypropyl)-1,2-oxazole-3-carboxamide
CID 102867000
N-cycloheptyl-N-methyl-1,3-thiazole-4-carboxamide
CID 63037212
2-acetamido-N-cyclobutyl-N-(3-hydroxypropyl)-1,3-thiazole-4-carboxamide
CID 102866785
N-cyclobutyl-4-(hydroxymethyl)-N-(3-hydroxypropyl)benzamide
CID 102866633
N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethyl-1,3-thiazole-4-carboxamide
CID 55145232
N-ethyl-N-pyrrolidin-3-yl-1,3-thiazole-4-carboxamide
CID 63299155

Frequently Asked Questions

What is the IUPAC name of N-cyclobutyl-N-(3-hydroxypropyl)-1,3-thiazole-4-carboxamide?
The IUPAC name of N-cyclobutyl-N-(3-hydroxypropyl)-1,3-thiazole-4-carboxamide (CID 102862752) is N-cyclobutyl-N-(3-hydroxypropyl)-1,3-thiazole-4-carboxamide.
What is the SMILES notation for N-cyclobutyl-N-(3-hydroxypropyl)-1,3-thiazole-4-carboxamide?
The canonical SMILES for N-cyclobutyl-N-(3-hydroxypropyl)-1,3-thiazole-4-carboxamide is O=C(c1cscn1)N(CCCO)C1CCC1.
What is the InChIKey of N-cyclobutyl-N-(3-hydroxypropyl)-1,3-thiazole-4-carboxamide?
The InChIKey is GMVIGLBBFAQTHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2S/c14-6-2-5-13(9-3-1-4-9)11(15)10-7-16-8-12-10/h7-9,14H,1-6H2.
What are the key properties of N-cyclobutyl-N-(3-hydroxypropyl)-1,3-thiazole-4-carboxamide?
N-cyclobutyl-N-(3-hydroxypropyl)-1,3-thiazole-4-carboxamide has a molecular weight of 240.33 g/mol, XLogP of 1.52, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclobutyl-N-(3-hydroxypropyl)-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 102862752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).