2-(furan-2-yl)-N-propan-2-yl-N-(pyridin-2-ylmethyl)-1,3-thiazole-4-carboxamide

C17H17N3O2S — CID 51088405

IUPAC2-(furan-2-yl)-N-propan-2-yl-N-(pyridin-2-ylmethyl)-1,3-thiazole-4-carboxamide
SMILESCC(C)N(Cc1ccccn1)C(=O)c1csc(-c2ccco2)n1
InChIInChI=1S/C17H17N3O2S/c1-12(2)20(10-13-6-3-4-8-18-13)17(21)14-11-23-16(19-14)15-7-5-9-22-15/h3-9,11-12H,10H2,1-2H3
InChIKeyCXIXSUVPNSLKCE-UHFFFAOYSA-N
MW327.41 g/mol
LogP3.85
Rot. Bonds5

About 2-(furan-2-yl)-N-propan-2-yl-N-(pyridin-2-ylmethyl)-1,3-thiazole-4-carboxamide

2-(furan-2-yl)-N-propan-2-yl-N-(pyridin-2-ylmethyl)-1,3-thiazole-4-carboxamide (PubChem CID 51088405) has the molecular formula C17H17N3O2S and a molecular weight of 327.41 g/mol. Its IUPAC name is 2-(furan-2-yl)-N-propan-2-yl-N-(pyridin-2-ylmethyl)-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name2-(furan-2-yl)-N-propan-2-yl-N-(pyridin-2-ylmethyl)-1,3-thiazole-4-carboxamide
PubChem CID51088405
Molecular FormulaC17H17N3O2S
Molecular Weight327.41 g/mol
Exact Mass327.10
IUPAC Name2-(furan-2-yl)-N-propan-2-yl-N-(pyridin-2-ylmethyl)-1,3-thiazole-4-carboxamide
SMILESCC(C)N(Cc1ccccn1)C(=O)c1csc(-c2ccco2)n1
InChIInChI=1S/C17H17N3O2S/c1-12(2)20(10-13-6-3-4-8-18-13)17(21)14-11-23-16(19-14)15-7-5-9-22-15/h3-9,11-12H,10H2,1-2H3
InChIKeyCXIXSUVPNSLKCE-UHFFFAOYSA-N
XLogP3.85
TPSA59.23 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.41
LogP ≤ 53.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 2-[[2-(furan-2-yl)-1,3-thiazole-4-carbonyl]-propan-2-ylamino]acetate
CID 60766057
2-(furan-2-yl)-N-methyl-N-(2-methylpropyl)-1,3-thiazole-4-carboxamide
CID 134058954
N-propan-2-yl-N-(pyridin-2-ylmethyl)thiophene-2-carboxamide
CID 61036038
2-[ethyl-[2-(furan-2-yl)-1,3-thiazole-4-carbonyl]amino]acetic acid
CID 61021145
2-[[2-(furan-2-yl)-1,3-thiazol-4-yl]methyl-propan-2-ylamino]acetamide
CID 86917359
N-ethyl-2-(furan-2-yl)-N-(2-methylprop-2-enyl)-1,3-thiazole-4-carboxamide
CID 47022125
2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-N-(2-hydroxyethyl)-N-propan-2-ylacetamide
CID 43573534
2-[[[2-(furan-2-yl)-1,3-thiazole-4-carbonyl]amino]methyl]-3-methylbutanoic acid
CID 65215285
N-[(4-bromophenyl)methyl]-2-(furan-2-yl)-N-methyl-1,3-thiazole-4-carboxamide
CID 36702476
2-(furan-2-yl)-N-methyl-N-[1-(4-methylsulfonylphenyl)ethyl]-1,3-thiazole-4-carboxamide
CID 55550855
2-(furan-2-yl)-N-(furan-2-ylmethyl)-N-(thiophen-2-ylmethyl)-1,3-thiazole-4-carboxamide
CID 31836479
N-propan-2-yl-N-(pyridin-2-ylmethyl)imidazo[1,2-a]pyrimidine-2-carboxamide
CID 51090689

Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-N-propan-2-yl-N-(pyridin-2-ylmethyl)-1,3-thiazole-4-carboxamide?
The IUPAC name of 2-(furan-2-yl)-N-propan-2-yl-N-(pyridin-2-ylmethyl)-1,3-thiazole-4-carboxamide (CID 51088405) is 2-(furan-2-yl)-N-propan-2-yl-N-(pyridin-2-ylmethyl)-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 2-(furan-2-yl)-N-propan-2-yl-N-(pyridin-2-ylmethyl)-1,3-thiazole-4-carboxamide?
The canonical SMILES for 2-(furan-2-yl)-N-propan-2-yl-N-(pyridin-2-ylmethyl)-1,3-thiazole-4-carboxamide is CC(C)N(Cc1ccccn1)C(=O)c1csc(-c2ccco2)n1.
What is the InChIKey of 2-(furan-2-yl)-N-propan-2-yl-N-(pyridin-2-ylmethyl)-1,3-thiazole-4-carboxamide?
The InChIKey is CXIXSUVPNSLKCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O2S/c1-12(2)20(10-13-6-3-4-8-18-13)17(21)14-11-23-16(19-14)15-7-5-9-22-15/h3-9,11-12H,10H2,1-2H3.
What are the key properties of 2-(furan-2-yl)-N-propan-2-yl-N-(pyridin-2-ylmethyl)-1,3-thiazole-4-carboxamide?
2-(furan-2-yl)-N-propan-2-yl-N-(pyridin-2-ylmethyl)-1,3-thiazole-4-carboxamide has a molecular weight of 327.41 g/mol, XLogP of 3.85, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-N-propan-2-yl-N-(pyridin-2-ylmethyl)-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 51088405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).