2-(3-methyl-4-propan-2-ylphenoxy)-N-(1,3-thiazol-2-yl)acetamide

C15H18N2O2S — CID 719778

IUPAC2-(3-methyl-4-propan-2-ylphenoxy)-N-(1,3-thiazol-2-yl)acetamide
SMILESCc1cc(OCC(=O)Nc2nccs2)ccc1C(C)C
InChIInChI=1S/C15H18N2O2S/c1-10(2)13-5-4-12(8-11(13)3)19-9-14(18)17-15-16-6-7-20-15/h4-8,10H,9H2,1-3H3,(H,16,17,18)
InChIKeyRTBHIMXTEORQIT-UHFFFAOYSA-N
MW290.39 g/mol
LogP3.59
Rot. Bonds5

About 2-(3-methyl-4-propan-2-ylphenoxy)-N-(1,3-thiazol-2-yl)acetamide

2-(3-methyl-4-propan-2-ylphenoxy)-N-(1,3-thiazol-2-yl)acetamide (PubChem CID 719778) has the molecular formula C15H18N2O2S and a molecular weight of 290.39 g/mol. Its IUPAC name is 2-(3-methyl-4-propan-2-ylphenoxy)-N-(1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-(3-methyl-4-propan-2-ylphenoxy)-N-(1,3-thiazol-2-yl)acetamide
PubChem CID719778
Molecular FormulaC15H18N2O2S
Molecular Weight290.39 g/mol
Exact Mass290.11
IUPAC Name2-(3-methyl-4-propan-2-ylphenoxy)-N-(1,3-thiazol-2-yl)acetamide
SMILESCc1cc(OCC(=O)Nc2nccs2)ccc1C(C)C
InChIInChI=1S/C15H18N2O2S/c1-10(2)13-5-4-12(8-11(13)3)19-9-14(18)17-15-16-6-7-20-15/h4-8,10H,9H2,1-3H3,(H,16,17,18)
InChIKeyRTBHIMXTEORQIT-UHFFFAOYSA-N
XLogP3.59
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 ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-methoxyphenoxy)-N-(1,3-thiazol-2-yl)acetamide
CID 721272
2-phenoxy-N-(1,3-thiazol-2-yl)acetamide
CID 2787061
2-(2,3-dimethylphenoxy)-N-(1,3-thiazol-2-yl)acetamide
CID 888214
2-naphthalen-2-yloxy-N-(1,3-thiazol-2-yl)acetamide
CID 910281
4-(2,3-dimethylphenoxy)-N-1,3-thiazol-2-ylbutanamide
CID 1575135
2-(4-ethoxyphenyl)-N-(1,3-thiazol-2-yl)acetamide
CID 2514833
2-(2,3-dihydro-1H-inden-5-yloxy)-N-(5-methyl-1,3-thiazol-2-yl)acetamide
CID 2678142
3-(4-methoxyphenyl)-4-methyl-N-(1,3-thiazol-2-yl)pentanamide
CID 3707305
2-(2,5-dimethylphenoxy)-N-(1,3-thiazol-2-yl)propanamide
CID 4944777
2-((4-methyl-2-oxo-2H-chromen-7-yl)oxy)-N-(thiazol-2-yl)acetamide
CID 8057412
2-({5-[(3-methylphenoxy)methyl]-1,3,4-oxadiazol-2-yl}sulfanyl)-N-(1,3-thiazol-2-yl)acetamide
CID 1276990
2-(4-fluorophenoxy)-N-(1,3-thiazol-2-yl)acetamide
CID 693869

Frequently Asked Questions

What is the IUPAC name of 2-(3-methyl-4-propan-2-ylphenoxy)-N-(1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-(3-methyl-4-propan-2-ylphenoxy)-N-(1,3-thiazol-2-yl)acetamide (CID 719778) is 2-(3-methyl-4-propan-2-ylphenoxy)-N-(1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-(3-methyl-4-propan-2-ylphenoxy)-N-(1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-(3-methyl-4-propan-2-ylphenoxy)-N-(1,3-thiazol-2-yl)acetamide is Cc1cc(OCC(=O)Nc2nccs2)ccc1C(C)C.
What is the InChIKey of 2-(3-methyl-4-propan-2-ylphenoxy)-N-(1,3-thiazol-2-yl)acetamide?
The InChIKey is RTBHIMXTEORQIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2S/c1-10(2)13-5-4-12(8-11(13)3)19-9-14(18)17-15-16-6-7-20-15/h4-8,10H,9H2,1-3H3,(H,16,17,18).
What are the key properties of 2-(3-methyl-4-propan-2-ylphenoxy)-N-(1,3-thiazol-2-yl)acetamide?
2-(3-methyl-4-propan-2-ylphenoxy)-N-(1,3-thiazol-2-yl)acetamide has a molecular weight of 290.39 g/mol, XLogP of 3.59, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methyl-4-propan-2-ylphenoxy)-N-(1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 719778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).