(E)-3-(5-methylfuran-2-yl)-N-(1,3-thiazol-2-yl)prop-2-enamide

C11H10N2O2S — CID 2315023

IUPAC(E)-3-(5-methylfuran-2-yl)-N-(1,3-thiazol-2-yl)prop-2-enamide
SMILESCc1ccc(/C=C/C(=O)Nc2nccs2)o1
InChIInChI=1S/C11H10N2O2S/c1-8-2-3-9(15-8)4-5-10(14)13-11-12-6-7-16-11/h2-7H,1H3,(H,12,13,14)/b5-4+
InChIKeyWXPPKRVWDCVHPH-SNAWJCMRSA-N
MW234.28 g/mol
LogP2.70
Rot. Bonds3

About (E)-3-(5-methylfuran-2-yl)-N-(1,3-thiazol-2-yl)prop-2-enamide

(E)-3-(5-methylfuran-2-yl)-N-(1,3-thiazol-2-yl)prop-2-enamide (PubChem CID 2315023) has the molecular formula C11H10N2O2S and a molecular weight of 234.28 g/mol. Its IUPAC name is (E)-3-(5-methylfuran-2-yl)-N-(1,3-thiazol-2-yl)prop-2-enamide.

Molecular Properties

Compound Name(E)-3-(5-methylfuran-2-yl)-N-(1,3-thiazol-2-yl)prop-2-enamide
PubChem CID2315023
Molecular FormulaC11H10N2O2S
Molecular Weight234.28 g/mol
Exact Mass234.05
IUPAC Name(E)-3-(5-methylfuran-2-yl)-N-(1,3-thiazol-2-yl)prop-2-enamide
SMILESCc1ccc(/C=C/C(=O)Nc2nccs2)o1
InChIInChI=1S/C11H10N2O2S/c1-8-2-3-9(15-8)4-5-10(14)13-11-12-6-7-16-11/h2-7H,1H3,(H,12,13,14)/b5-4+
InChIKeyWXPPKRVWDCVHPH-SNAWJCMRSA-N
XLogP2.70
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.28
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

(5Z)-5-(2-furylmethylene)-2-imino-3-(1,3-thiazol-2-yl)-1,3-thiazolidin-4-one
CID 5953874
Thiourea, N-(2-(2-furanyl)ethyl)-N'-2-thiazolyl-
CID 3001099
2-Amino-5-thio-substituted thiazole 64
CID 5329700
(E)-3-(5-bromofuran-2-yl)-N-(5-methyl-1,3-thiazol-2-yl)prop-2-enamide
CID 2116524
(E)-3-(5-bromofuran-2-yl)-N-(1,3-thiazol-2-yl)prop-2-enamide
CID 2314813
4-phenoxy-N-(1,3-thiazol-2-yl)butanamide
CID 1570036
N-Furan-2-ylmethyl-N'-thiazol-2-yl-oxalamide
CID 1978650
3-(5-methyl-2-furyl)-N-(4-methyl-1,3-thiazol-2-yl)acrylamide
CID 896849
(2E)-3-(2-furyl)-N-(4-methyl(1,3-thiazol-2-yl))prop-2-enamide
CID 2163560
(E)-3-(5-methylfuran-2-yl)-N-(5-methyl-1,3-thiazol-2-yl)prop-2-enamide
CID 2673021
2-methyl-N-(1,3-thiazol-2-yl)furan-3-carboxamide
CID 874518
5-(2-Furylmethylene)-2-imino-3-(1,3-thiazol-2-yl)-1,3-thiazolidin-4-one
CID 7918703

Frequently Asked Questions

What is the IUPAC name of (E)-3-(5-methylfuran-2-yl)-N-(1,3-thiazol-2-yl)prop-2-enamide?
The IUPAC name of (E)-3-(5-methylfuran-2-yl)-N-(1,3-thiazol-2-yl)prop-2-enamide (CID 2315023) is (E)-3-(5-methylfuran-2-yl)-N-(1,3-thiazol-2-yl)prop-2-enamide.
What is the SMILES notation for (E)-3-(5-methylfuran-2-yl)-N-(1,3-thiazol-2-yl)prop-2-enamide?
The canonical SMILES for (E)-3-(5-methylfuran-2-yl)-N-(1,3-thiazol-2-yl)prop-2-enamide is Cc1ccc(/C=C/C(=O)Nc2nccs2)o1.
What is the InChIKey of (E)-3-(5-methylfuran-2-yl)-N-(1,3-thiazol-2-yl)prop-2-enamide?
The InChIKey is WXPPKRVWDCVHPH-SNAWJCMRSA-N. The full InChI is InChI=1S/C11H10N2O2S/c1-8-2-3-9(15-8)4-5-10(14)13-11-12-6-7-16-11/h2-7H,1H3,(H,12,13,14)/b5-4+.
What are the key properties of (E)-3-(5-methylfuran-2-yl)-N-(1,3-thiazol-2-yl)prop-2-enamide?
(E)-3-(5-methylfuran-2-yl)-N-(1,3-thiazol-2-yl)prop-2-enamide has a molecular weight of 234.28 g/mol, XLogP of 2.70, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-(5-methylfuran-2-yl)-N-(1,3-thiazol-2-yl)prop-2-enamide is sourced from PubChem (CID 2315023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).