tert-butyl N-[5-(cyclohexanecarbonyl)-4-(furan-2-yl)-1,3-thiazol-2-yl]carbamate

C19H24N2O4S — CID 23144478

IUPACtert-butyl N-[5-(cyclohexanecarbonyl)-4-(furan-2-yl)-1,3-thiazol-2-yl]carbamate
SMILESCC(C)(C)OC(=O)Nc1nc(-c2ccco2)c(C(=O)C2CCCCC2)s1
InChIInChI=1S/C19H24N2O4S/c1-19(2,3)25-18(23)21-17-20-14(13-10-7-11-24-13)16(26-17)15(22)12-8-5-4-6-9-12/h7,10-12H,4-6,8-9H2,1-3H3,(H,20,21,23)
InChIKeyAIIPOWUFNMAUNA-UHFFFAOYSA-N
MW376.48 g/mol
LogP5.51
Rot. Bonds4

About tert-butyl N-[5-(cyclohexanecarbonyl)-4-(furan-2-yl)-1,3-thiazol-2-yl]carbamate

tert-butyl N-[5-(cyclohexanecarbonyl)-4-(furan-2-yl)-1,3-thiazol-2-yl]carbamate (PubChem CID 23144478) has the molecular formula C19H24N2O4S and a molecular weight of 376.48 g/mol. Its IUPAC name is tert-butyl N-[5-(cyclohexanecarbonyl)-4-(furan-2-yl)-1,3-thiazol-2-yl]carbamate.

Molecular Properties

Compound Nametert-butyl N-[5-(cyclohexanecarbonyl)-4-(furan-2-yl)-1,3-thiazol-2-yl]carbamate
PubChem CID23144478
Molecular FormulaC19H24N2O4S
Molecular Weight376.48 g/mol
Exact Mass376.15
IUPAC Nametert-butyl N-[5-(cyclohexanecarbonyl)-4-(furan-2-yl)-1,3-thiazol-2-yl]carbamate
SMILESCC(C)(C)OC(=O)Nc1nc(-c2ccco2)c(C(=O)C2CCCCC2)s1
InChIInChI=1S/C19H24N2O4S/c1-19(2,3)25-18(23)21-17-20-14(13-10-7-11-24-13)16(26-17)15(22)12-8-5-4-6-9-12/h7,10-12H,4-6,8-9H2,1-3H3,(H,20,21,23)
InChIKeyAIIPOWUFNMAUNA-UHFFFAOYSA-N
XLogP5.51
TPSA81.43 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500376.48
LogP ≤ 55.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze tert-butyl N-[5-(cyclohexanecarbonyl)-4-(furan-2-yl)-1,3-thiazol-2-yl]carbamate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

tert-butyl N-[4-(furan-2-yl)-5-(3-methoxypropanoyl)-1,3-thiazol-2-yl]carbamate
CID 23144787
[4-(furan-2-yl)-5-(4-methoxycyclohexanecarbonyl)-1,3-thiazol-2-yl]carbamic acid
CID 87218339
tert-butyl N-[4-(furan-2-yl)-5-(2-methoxybenzoyl)-1,3-thiazol-2-yl]carbamate
CID 23144140
[4-(furan-2-yl)-2-(methylamino)-1,3-thiazol-5-yl]-(oxan-4-yl)methanone
CID 87218284
tert-butyl N-[4-(furan-2-yl)-5-(5-methoxypyridine-2-carbonyl)-1,3-thiazol-2-yl]carbamate
CID 23144098
tert-butyl N-[4-(furan-2-yl)-5-(2-methoxypyridine-4-carbonyl)-1,3-thiazol-2-yl]carbamate
CID 23144577
N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]oxolane-2-carboxamide
CID 23144496
[5-(1,4-dioxaspiro[4.5]decane-8-carbonyl)-4-(furan-2-yl)-1,3-thiazol-2-yl]carbamic acid
CID 87218784
N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]-2-pyrrolidin-1-ylacetamide
CID 23144422
N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]-2-[4-(2-hydroxypropan-2-yl)piperidin-1-yl]acetamide
CID 23144713
N-[4-(furan-2-yl)-5-(4-oxocyclohexanecarbonyl)-1,3-thiazol-2-yl]-3-methoxybenzamide
CID 23144318
N-[4-(furan-2-yl)-5-(2-methylpropanoyl)-1,3-thiazol-2-yl]cyclopropanecarboxamide
CID 23144378

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-[5-(cyclohexanecarbonyl)-4-(furan-2-yl)-1,3-thiazol-2-yl]carbamate?
The IUPAC name of tert-butyl N-[5-(cyclohexanecarbonyl)-4-(furan-2-yl)-1,3-thiazol-2-yl]carbamate (CID 23144478) is tert-butyl N-[5-(cyclohexanecarbonyl)-4-(furan-2-yl)-1,3-thiazol-2-yl]carbamate.
What is the SMILES notation for tert-butyl N-[5-(cyclohexanecarbonyl)-4-(furan-2-yl)-1,3-thiazol-2-yl]carbamate?
The canonical SMILES for tert-butyl N-[5-(cyclohexanecarbonyl)-4-(furan-2-yl)-1,3-thiazol-2-yl]carbamate is CC(C)(C)OC(=O)Nc1nc(-c2ccco2)c(C(=O)C2CCCCC2)s1.
What is the InChIKey of tert-butyl N-[5-(cyclohexanecarbonyl)-4-(furan-2-yl)-1,3-thiazol-2-yl]carbamate?
The InChIKey is AIIPOWUFNMAUNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4S/c1-19(2,3)25-18(23)21-17-20-14(13-10-7-11-24-13)16(26-17)15(22)12-8-5-4-6-9-12/h7,10-12H,4-6,8-9H2,1-3H3,(H,20,21,23).
What are the key properties of tert-butyl N-[5-(cyclohexanecarbonyl)-4-(furan-2-yl)-1,3-thiazol-2-yl]carbamate?
tert-butyl N-[5-(cyclohexanecarbonyl)-4-(furan-2-yl)-1,3-thiazol-2-yl]carbamate has a molecular weight of 376.48 g/mol, XLogP of 5.51, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-[5-(cyclohexanecarbonyl)-4-(furan-2-yl)-1,3-thiazol-2-yl]carbamate is sourced from PubChem (CID 23144478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).