N-cyclobutyl-2-(furan-2-yl)-N-(2-hydroxyethyl)-5-methyl-1,3-thiazole-4-carboxamide

C15H18N2O3S — CID 102684339

IUPACN-cyclobutyl-2-(furan-2-yl)-N-(2-hydroxyethyl)-5-methyl-1,3-thiazole-4-carboxamide
SMILESCc1sc(-c2ccco2)nc1C(=O)N(CCO)C1CCC1
InChIInChI=1S/C15H18N2O3S/c1-10-13(16-14(21-10)12-6-3-9-20-12)15(19)17(7-8-18)11-4-2-5-11/h3,6,9,11,18H,2,4-5,7-8H2,1H3
InChIKeyZDDRUQRJYBLXNQ-UHFFFAOYSA-N
MW306.39 g/mol
LogP2.70
Rot. Bonds5

About N-cyclobutyl-2-(furan-2-yl)-N-(2-hydroxyethyl)-5-methyl-1,3-thiazole-4-carboxamide

N-cyclobutyl-2-(furan-2-yl)-N-(2-hydroxyethyl)-5-methyl-1,3-thiazole-4-carboxamide (PubChem CID 102684339) has the molecular formula C15H18N2O3S and a molecular weight of 306.39 g/mol. Its IUPAC name is N-cyclobutyl-2-(furan-2-yl)-N-(2-hydroxyethyl)-5-methyl-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound NameN-cyclobutyl-2-(furan-2-yl)-N-(2-hydroxyethyl)-5-methyl-1,3-thiazole-4-carboxamide
PubChem CID102684339
Molecular FormulaC15H18N2O3S
Molecular Weight306.39 g/mol
Exact Mass306.10
IUPAC NameN-cyclobutyl-2-(furan-2-yl)-N-(2-hydroxyethyl)-5-methyl-1,3-thiazole-4-carboxamide
SMILESCc1sc(-c2ccco2)nc1C(=O)N(CCO)C1CCC1
InChIInChI=1S/C15H18N2O3S/c1-10-13(16-14(21-10)12-6-3-9-20-12)15(19)17(7-8-18)11-4-2-5-11/h3,6,9,11,18H,2,4-5,7-8H2,1H3
InChIKeyZDDRUQRJYBLXNQ-UHFFFAOYSA-N
XLogP2.70
TPSA66.57 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.39
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclobutyl-2-(furan-2-yl)-N-(2-hydroxyethyl)-5-methyl-1,3-thiazole-4-carboxamide?
The IUPAC name of N-cyclobutyl-2-(furan-2-yl)-N-(2-hydroxyethyl)-5-methyl-1,3-thiazole-4-carboxamide (CID 102684339) is N-cyclobutyl-2-(furan-2-yl)-N-(2-hydroxyethyl)-5-methyl-1,3-thiazole-4-carboxamide.
What is the SMILES notation for N-cyclobutyl-2-(furan-2-yl)-N-(2-hydroxyethyl)-5-methyl-1,3-thiazole-4-carboxamide?
The canonical SMILES for N-cyclobutyl-2-(furan-2-yl)-N-(2-hydroxyethyl)-5-methyl-1,3-thiazole-4-carboxamide is Cc1sc(-c2ccco2)nc1C(=O)N(CCO)C1CCC1.
What is the InChIKey of N-cyclobutyl-2-(furan-2-yl)-N-(2-hydroxyethyl)-5-methyl-1,3-thiazole-4-carboxamide?
The InChIKey is ZDDRUQRJYBLXNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O3S/c1-10-13(16-14(21-10)12-6-3-9-20-12)15(19)17(7-8-18)11-4-2-5-11/h3,6,9,11,18H,2,4-5,7-8H2,1H3.
What are the key properties of N-cyclobutyl-2-(furan-2-yl)-N-(2-hydroxyethyl)-5-methyl-1,3-thiazole-4-carboxamide?
N-cyclobutyl-2-(furan-2-yl)-N-(2-hydroxyethyl)-5-methyl-1,3-thiazole-4-carboxamide has a molecular weight of 306.39 g/mol, XLogP of 2.70, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclobutyl-2-(furan-2-yl)-N-(2-hydroxyethyl)-5-methyl-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 102684339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).