N-[4-(2,5-dimethylfuran-3-yl)-1,3-thiazol-2-yl]acetamide

C11H12N2O2S — CID 47066446

IUPACN-[4-(2,5-dimethylfuran-3-yl)-1,3-thiazol-2-yl]acetamide
SMILESCC(=O)Nc1nc(-c2cc(C)oc2C)cs1
InChIInChI=1S/C11H12N2O2S/c1-6-4-9(7(2)15-6)10-5-16-11(13-10)12-8(3)14/h4-5H,1-3H3,(H,12,13,14)
InChIKeyFHCGPZFWQJPYAQ-UHFFFAOYSA-N
MW236.30 g/mol
LogP2.98
Rot. Bonds2

About N-[4-(2,5-dimethylfuran-3-yl)-1,3-thiazol-2-yl]acetamide

N-[4-(2,5-dimethylfuran-3-yl)-1,3-thiazol-2-yl]acetamide (PubChem CID 47066446) has the molecular formula C11H12N2O2S and a molecular weight of 236.30 g/mol. Its IUPAC name is N-[4-(2,5-dimethylfuran-3-yl)-1,3-thiazol-2-yl]acetamide.

Molecular Properties

Compound NameN-[4-(2,5-dimethylfuran-3-yl)-1,3-thiazol-2-yl]acetamide
PubChem CID47066446
Molecular FormulaC11H12N2O2S
Molecular Weight236.30 g/mol
Exact Mass236.06
IUPAC NameN-[4-(2,5-dimethylfuran-3-yl)-1,3-thiazol-2-yl]acetamide
SMILESCC(=O)Nc1nc(-c2cc(C)oc2C)cs1
InChIInChI=1S/C11H12N2O2S/c1-6-4-9(7(2)15-6)10-5-16-11(13-10)12-8(3)14/h4-5H,1-3H3,(H,12,13,14)
InChIKeyFHCGPZFWQJPYAQ-UHFFFAOYSA-N
XLogP2.98
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.30
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-2-amino-N-[4-(2,5-dimethylfuran-3-yl)-1,3-thiazol-2-yl]propanamide;hydrochloride
CID 119300524
N-[4-(2,5-dimethylfuran-3-yl)-1,3-thiazol-2-yl]piperidine-4-carboxamide
CID 119300523
N-[4-(2,5-dimethylfuran-3-yl)-1,3-thiazol-2-yl]-4-methylsulfonylbenzamide
CID 55922780
(2R)-2-(cyclopropylmethoxy)-N-[4-(2,5-dimethylfuran-3-yl)-1,3-thiazol-2-yl]propanamide
CID 52539367
N-[4-[2-[[4-(2,5-dimethylfuran-3-yl)-1,3-thiazol-2-yl]amino]-2-oxoethyl]-1,3-thiazol-2-yl]benzamide
CID 55921614
N-[4-(2,5-dimethylfuran-3-yl)-1,3-thiazol-2-yl]-2-fluoro-5-methylsulfonylbenzamide
CID 75526136
N-[4-(2,5-dimethylfuran-3-yl)-1,3-thiazol-2-yl]-4,4,4-trifluoro-3-hydroxy-3-(1-methylimidazol-2-yl)butanamide
CID 55975651
3-(1,3-benzothiazol-2-yl)-N-[4-(2,5-dimethylfuran-3-yl)-1,3-thiazol-2-yl]propanamide
CID 55922394
N-[4-(2,5-diethoxyphenyl)-1,3-thiazol-2-yl]acetamide
CID 17404838
N-[2-[[4-(2,5-dimethylfuran-3-yl)-1,3-thiazol-2-yl]amino]-2-oxoethyl]-1,3-benzodioxole-5-carboxamide
CID 55976415
N-[4-(2,5-dimethylfuran-3-yl)-1,3-thiazol-2-yl]-6-ethoxy-1H-indole-2-carboxamide
CID 55976160
N-[4-(2,5-dimethylfuran-3-yl)-1,3-thiazol-2-yl]-7,7-dimethyl-2,5-dioxo-6,8-dihydro-1H-quinoline-3-carboxamide
CID 56564971

Frequently Asked Questions

What is the IUPAC name of N-[4-(2,5-dimethylfuran-3-yl)-1,3-thiazol-2-yl]acetamide?
The IUPAC name of N-[4-(2,5-dimethylfuran-3-yl)-1,3-thiazol-2-yl]acetamide (CID 47066446) is N-[4-(2,5-dimethylfuran-3-yl)-1,3-thiazol-2-yl]acetamide.
What is the SMILES notation for N-[4-(2,5-dimethylfuran-3-yl)-1,3-thiazol-2-yl]acetamide?
The canonical SMILES for N-[4-(2,5-dimethylfuran-3-yl)-1,3-thiazol-2-yl]acetamide is CC(=O)Nc1nc(-c2cc(C)oc2C)cs1.
What is the InChIKey of N-[4-(2,5-dimethylfuran-3-yl)-1,3-thiazol-2-yl]acetamide?
The InChIKey is FHCGPZFWQJPYAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O2S/c1-6-4-9(7(2)15-6)10-5-16-11(13-10)12-8(3)14/h4-5H,1-3H3,(H,12,13,14).
What are the key properties of N-[4-(2,5-dimethylfuran-3-yl)-1,3-thiazol-2-yl]acetamide?
N-[4-(2,5-dimethylfuran-3-yl)-1,3-thiazol-2-yl]acetamide has a molecular weight of 236.30 g/mol, XLogP of 2.98, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2,5-dimethylfuran-3-yl)-1,3-thiazol-2-yl]acetamide is sourced from PubChem (CID 47066446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).