4-ethoxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)benzamide

C15H18N2O2S — CID 22170489

IUPAC4-ethoxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)benzamide
SMILESCCOc1ccc(C(=O)Nc2ncc(C(C)C)s2)cc1
InChIInChI=1S/C15H18N2O2S/c1-4-19-12-7-5-11(6-8-12)14(18)17-15-16-9-13(20-15)10(2)3/h5-10H,4H2,1-3H3,(H,16,17,18)
InChIKeyWGFAOEAPVIIPDY-UHFFFAOYSA-N
MW290.39 g/mol
LogP3.92
Rot. Bonds5

About 4-ethoxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)benzamide

4-ethoxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)benzamide (PubChem CID 22170489) has the molecular formula C15H18N2O2S and a molecular weight of 290.39 g/mol. Its IUPAC name is 4-ethoxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name4-ethoxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)benzamide
PubChem CID22170489
Molecular FormulaC15H18N2O2S
Molecular Weight290.39 g/mol
Exact Mass290.11
IUPAC Name4-ethoxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)benzamide
SMILESCCOc1ccc(C(=O)Nc2ncc(C(C)C)s2)cc1
InChIInChI=1S/C15H18N2O2S/c1-4-19-12-7-5-11(6-8-12)14(18)17-15-16-9-13(20-15)10(2)3/h5-10H,4H2,1-3H3,(H,16,17,18)
InChIKeyWGFAOEAPVIIPDY-UHFFFAOYSA-N
XLogP3.92
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.39
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 4-[(5-propan-2-yl-1,3-thiazol-2-yl)carbamoyl]benzoate
CID 22170458
4-[(5-propan-2-yl-1,3-thiazol-2-yl)carbamoyl]benzoic acid
CID 87952464
4-(hydroxymethyl)-N-(5-propan-2-yl-1,3-thiazol-2-yl)benzamide
CID 22170724
4-cyano-N-(5-propan-2-yl-1,3-thiazol-2-yl)benzamide
CID 22170568
4-methylsulfanyl-N-(5-propan-2-yl-1,3-thiazol-2-yl)benzamide
CID 22170516
N-(5-cyano-1,3-thiazol-2-yl)-4-ethoxybenzamide
CID 90603554
3,4-dimethoxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)benzamide
CID 22170799
3,5-dimethoxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)benzamide
CID 22170540
4-ethoxy-N-[5-[(4-methylphenyl)methyl]-1,3-thiazol-2-yl]benzamide
CID 4684424
4-cyclohex-2-en-1-yloxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)benzamide
CID 22170550
4-ethoxy-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)benzamide
CID 1086877
4-ethoxy-N-[5-(2-methylpropylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide
CID 100763253

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)benzamide?
The IUPAC name of 4-ethoxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)benzamide (CID 22170489) is 4-ethoxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 4-ethoxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 4-ethoxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)benzamide is CCOc1ccc(C(=O)Nc2ncc(C(C)C)s2)cc1.
What is the InChIKey of 4-ethoxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)benzamide?
The InChIKey is WGFAOEAPVIIPDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2S/c1-4-19-12-7-5-11(6-8-12)14(18)17-15-16-9-13(20-15)10(2)3/h5-10H,4H2,1-3H3,(H,16,17,18).
What are the key properties of 4-ethoxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)benzamide?
4-ethoxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)benzamide has a molecular weight of 290.39 g/mol, XLogP of 3.92, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 22170489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).