2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]acetamide

C21H29N3O3S — CID 31759283

IUPAC2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]acetamide
SMILESCc1oc(-c2cccs2)nc1CC(=O)NCC1(N2CCOCC2)CCCCC1
InChIInChI=1S/C21H29N3O3S/c1-16-17(23-20(27-16)18-6-5-13-28-18)14-19(25)22-15-21(7-3-2-4-8-21)24-9-11-26-12-10-24/h5-6,13H,2-4,7-12,14-15H2,1H3,(H,22,25)
InChIKeyFMBZHVPCXWGYGO-UHFFFAOYSA-N
MW403.55 g/mol
LogP3.41
Rot. Bonds6

About 2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]acetamide

2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]acetamide (PubChem CID 31759283) has the molecular formula C21H29N3O3S and a molecular weight of 403.55 g/mol. Its IUPAC name is 2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]acetamide.

Molecular Properties

Compound Name2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]acetamide
PubChem CID31759283
Molecular FormulaC21H29N3O3S
Molecular Weight403.55 g/mol
Exact Mass403.19
IUPAC Name2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]acetamide
SMILESCc1oc(-c2cccs2)nc1CC(=O)NCC1(N2CCOCC2)CCCCC1
InChIInChI=1S/C21H29N3O3S/c1-16-17(23-20(27-16)18-6-5-13-28-18)14-19(25)22-15-21(7-3-2-4-8-21)24-9-11-26-12-10-24/h5-6,13H,2-4,7-12,14-15H2,1H3,(H,22,25)
InChIKeyFMBZHVPCXWGYGO-UHFFFAOYSA-N
XLogP3.41
TPSA67.60 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.55
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]acetamide with MolForge

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Related Compounds

2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)-N-[(1-phenylcyclopropyl)methyl]acetamide
CID 31046939
2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide
CID 46542401
2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)-N-(4-morpholin-4-ylphenyl)acetamide
CID 31046848
N-(2-aminoethyl)-2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetamide
CID 119384938
N-(2,4-dimorpholin-4-ylphenyl)-2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetamide
CID 24627594
1-[(1-morpholin-4-ylcyclohexyl)methyl]-3-(thiophen-2-ylmethyl)urea
CID 134056877
2-[1-[[2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetyl]amino]cyclobutyl]acetic acid
CID 119217586
2-methyl-2-[[2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetyl]amino]cyclohexane-1-carboxylic acid
CID 120545472
N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetamide
CID 134027920
N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetamide
CID 24627396
N-[(5-chlorothiophen-2-yl)methyl]-2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetamide
CID 32832937
2-(3,4-dichlorophenyl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]acetamide
CID 2542286

Frequently Asked Questions

What is the IUPAC name of 2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]acetamide?
The IUPAC name of 2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]acetamide (CID 31759283) is 2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]acetamide.
What is the SMILES notation for 2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]acetamide?
The canonical SMILES for 2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]acetamide is Cc1oc(-c2cccs2)nc1CC(=O)NCC1(N2CCOCC2)CCCCC1.
What is the InChIKey of 2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]acetamide?
The InChIKey is FMBZHVPCXWGYGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H29N3O3S/c1-16-17(23-20(27-16)18-6-5-13-28-18)14-19(25)22-15-21(7-3-2-4-8-21)24-9-11-26-12-10-24/h5-6,13H,2-4,7-12,14-15H2,1H3,(H,22,25).
What are the key properties of 2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]acetamide?
2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]acetamide has a molecular weight of 403.55 g/mol, XLogP of 3.41, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]acetamide is sourced from PubChem (CID 31759283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).