N-ethyl-N-pyrrolidin-3-yl-1,3-thiazole-4-carboxamide

C10H15N3OS — CID 63299155

IUPACN-ethyl-N-pyrrolidin-3-yl-1,3-thiazole-4-carboxamide
SMILESCCN(C(=O)c1cscn1)C1CCNC1
InChIInChI=1S/C10H15N3OS/c1-2-13(8-3-4-11-5-8)10(14)9-6-15-7-12-9/h6-8,11H,2-5H2,1H3
InChIKeyGHSGHEJVXLCJGE-UHFFFAOYSA-N
MW225.32 g/mol
LogP0.97
Rot. Bonds3

About N-ethyl-N-pyrrolidin-3-yl-1,3-thiazole-4-carboxamide

N-ethyl-N-pyrrolidin-3-yl-1,3-thiazole-4-carboxamide (PubChem CID 63299155) has the molecular formula C10H15N3OS and a molecular weight of 225.32 g/mol. Its IUPAC name is N-ethyl-N-pyrrolidin-3-yl-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound NameN-ethyl-N-pyrrolidin-3-yl-1,3-thiazole-4-carboxamide
PubChem CID63299155
Molecular FormulaC10H15N3OS
Molecular Weight225.32 g/mol
Exact Mass225.09
IUPAC NameN-ethyl-N-pyrrolidin-3-yl-1,3-thiazole-4-carboxamide
SMILESCCN(C(=O)c1cscn1)C1CCNC1
InChIInChI=1S/C10H15N3OS/c1-2-13(8-3-4-11-5-8)10(14)9-6-15-7-12-9/h6-8,11H,2-5H2,1H3
InChIKeyGHSGHEJVXLCJGE-UHFFFAOYSA-N
XLogP0.97
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.32
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopentyl-N-ethyl-1,3-thiazole-4-carboxamide
CID 63037041
N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethyl-1,3-thiazole-4-carboxamide
CID 55145232
N-ethyl-1-methyl-N-pyrrolidin-3-ylimidazole-4-carboxamide
CID 107971834
N-ethyl-2-methyl-N-piperidin-3-yl-1,3-thiazole-4-carboxamide
CID 65198740
N-ethyl-2-methyl-N-piperidin-4-yl-1,3-thiazole-4-carboxamide
CID 65198571
N-ethyl-N-pyrrolidin-3-ylpyridine-3-carboxamide
CID 63299166
4,5-dibromo-N-ethyl-N-pyrrolidin-3-ylthiophene-2-carboxamide
CID 80537895
N-ethyl-N-pyrrolidin-3-yl-4-(trifluoromethyl)benzamide
CID 60806173
N-cyclobutyl-N-(2-hydroxyethyl)-1,3-thiazole-4-carboxamide
CID 102684545
5-chloro-N-ethyl-N-pyrrolidin-3-ylthiophene-2-carboxamide
CID 63299732
pyrrolidin-3-yl(1,3-thiazol-4-yl)methanone
CID 130670441
3-[cyclopropyl(1,3-thiazole-4-carbonyl)amino]propanoic acid
CID 63024405

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-pyrrolidin-3-yl-1,3-thiazole-4-carboxamide?
The IUPAC name of N-ethyl-N-pyrrolidin-3-yl-1,3-thiazole-4-carboxamide (CID 63299155) is N-ethyl-N-pyrrolidin-3-yl-1,3-thiazole-4-carboxamide.
What is the SMILES notation for N-ethyl-N-pyrrolidin-3-yl-1,3-thiazole-4-carboxamide?
The canonical SMILES for N-ethyl-N-pyrrolidin-3-yl-1,3-thiazole-4-carboxamide is CCN(C(=O)c1cscn1)C1CCNC1.
What is the InChIKey of N-ethyl-N-pyrrolidin-3-yl-1,3-thiazole-4-carboxamide?
The InChIKey is GHSGHEJVXLCJGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3OS/c1-2-13(8-3-4-11-5-8)10(14)9-6-15-7-12-9/h6-8,11H,2-5H2,1H3.
What are the key properties of N-ethyl-N-pyrrolidin-3-yl-1,3-thiazole-4-carboxamide?
N-ethyl-N-pyrrolidin-3-yl-1,3-thiazole-4-carboxamide has a molecular weight of 225.32 g/mol, XLogP of 0.97, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-pyrrolidin-3-yl-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 63299155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).