N-tert-butyl-3-(furan-2-carbonyl)-2-(2-methylpropyl)-1,3-thiazolidine-4-carboxamide

C17H26N2O3S — CID 42744887

IUPACN-tert-butyl-3-(furan-2-carbonyl)-2-(2-methylpropyl)-1,3-thiazolidine-4-carboxamide
SMILESCC(C)CC1SCC(C(=O)NC(C)(C)C)N1C(=O)c1ccco1
InChIInChI=1S/C17H26N2O3S/c1-11(2)9-14-19(16(21)13-7-6-8-22-13)12(10-23-14)15(20)18-17(3,4)5/h6-8,11-12,14H,9-10H2,1-5H3,(H,18,20)
InChIKeyLRZGKQPBGGWCRO-UHFFFAOYSA-N
MW338.47 g/mol
LogP3.12
Rot. Bonds4

About N-tert-butyl-3-(furan-2-carbonyl)-2-(2-methylpropyl)-1,3-thiazolidine-4-carboxamide

N-tert-butyl-3-(furan-2-carbonyl)-2-(2-methylpropyl)-1,3-thiazolidine-4-carboxamide (PubChem CID 42744887) has the molecular formula C17H26N2O3S and a molecular weight of 338.47 g/mol. Its IUPAC name is N-tert-butyl-3-(furan-2-carbonyl)-2-(2-methylpropyl)-1,3-thiazolidine-4-carboxamide.

Molecular Properties

Compound NameN-tert-butyl-3-(furan-2-carbonyl)-2-(2-methylpropyl)-1,3-thiazolidine-4-carboxamide
PubChem CID42744887
Molecular FormulaC17H26N2O3S
Molecular Weight338.47 g/mol
Exact Mass338.17
IUPAC NameN-tert-butyl-3-(furan-2-carbonyl)-2-(2-methylpropyl)-1,3-thiazolidine-4-carboxamide
SMILESCC(C)CC1SCC(C(=O)NC(C)(C)C)N1C(=O)c1ccco1
InChIInChI=1S/C17H26N2O3S/c1-11(2)9-14-19(16(21)13-7-6-8-22-13)12(10-23-14)15(20)18-17(3,4)5/h6-8,11-12,14H,9-10H2,1-5H3,(H,18,20)
InChIKeyLRZGKQPBGGWCRO-UHFFFAOYSA-N
XLogP3.12
TPSA62.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.47
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-benzyl-3-(furan-2-carbonyl)-2-(2-methylpropyl)-1,3-thiazolidine-4-carboxamide
CID 42744889
N-butyl-3-(furan-2-carbonyl)-2-(2-methylpropyl)-1,3-thiazolidine-4-carboxamide
CID 42744888
N-(furan-2-ylmethyl)-3-(2-methylpropanoyl)-2-(2-methylpropyl)-1,3-thiazolidine-4-carboxamide
CID 42748082
N-butan-2-yl-3-(4-tert-butylbenzoyl)-2-(2-methylpropyl)-1,3-thiazolidine-4-carboxamide
CID 42745410
3-(2-methylbenzoyl)-2-(2-methylpropyl)-N-(1-phenylethyl)-1,3-thiazolidine-4-carboxamide
CID 3951099
3-(furan-2-carbonyl)-N-(2-piperidin-1-ylethyl)-2-propan-2-yl-1,3-thiazolidine-4-carboxamide
CID 42744800
3-(4-methoxybenzoyl)-2-(2-methylpropyl)-N-(2-phenylethyl)-1,3-thiazolidine-4-carboxamide
CID 42748190
[3-(furan-2-carbonyl)-2-propyl-1,3-thiazolidin-4-yl]-morpholin-4-ylmethanone
CID 42749192
3-(2-fluorobenzoyl)-2-(2-methylpropyl)-N-propyl-1,3-thiazolidine-4-carboxamide
CID 42745397
[3-(furan-2-carbonyl)-2-propyl-1,3-thiazolidin-4-yl]-(4-methylpiperidin-1-yl)methanone
CID 42749204
(2R,4R)-3-(2-methylbenzoyl)-2-(2-methylpropyl)-1,3-thiazolidine-4-carboxylic acid
CID 809608
3-(4-fluorobenzoyl)-N-(3-methylbutyl)-2-(2-methylpropyl)-1,3-thiazolidine-4-carboxamide
CID 42745364

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-3-(furan-2-carbonyl)-2-(2-methylpropyl)-1,3-thiazolidine-4-carboxamide?
The IUPAC name of N-tert-butyl-3-(furan-2-carbonyl)-2-(2-methylpropyl)-1,3-thiazolidine-4-carboxamide (CID 42744887) is N-tert-butyl-3-(furan-2-carbonyl)-2-(2-methylpropyl)-1,3-thiazolidine-4-carboxamide.
What is the SMILES notation for N-tert-butyl-3-(furan-2-carbonyl)-2-(2-methylpropyl)-1,3-thiazolidine-4-carboxamide?
The canonical SMILES for N-tert-butyl-3-(furan-2-carbonyl)-2-(2-methylpropyl)-1,3-thiazolidine-4-carboxamide is CC(C)CC1SCC(C(=O)NC(C)(C)C)N1C(=O)c1ccco1.
What is the InChIKey of N-tert-butyl-3-(furan-2-carbonyl)-2-(2-methylpropyl)-1,3-thiazolidine-4-carboxamide?
The InChIKey is LRZGKQPBGGWCRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O3S/c1-11(2)9-14-19(16(21)13-7-6-8-22-13)12(10-23-14)15(20)18-17(3,4)5/h6-8,11-12,14H,9-10H2,1-5H3,(H,18,20).
What are the key properties of N-tert-butyl-3-(furan-2-carbonyl)-2-(2-methylpropyl)-1,3-thiazolidine-4-carboxamide?
N-tert-butyl-3-(furan-2-carbonyl)-2-(2-methylpropyl)-1,3-thiazolidine-4-carboxamide has a molecular weight of 338.47 g/mol, XLogP of 3.12, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-3-(furan-2-carbonyl)-2-(2-methylpropyl)-1,3-thiazolidine-4-carboxamide is sourced from PubChem (CID 42744887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).