N-(3-cyclohexyl-4-methyl-1,2-oxazol-5-yl)-6-ethoxypyridine-3-sulfonamide

C17H23N3O4S — CID 126816285

IUPACN-(3-cyclohexyl-4-methyl-1,2-oxazol-5-yl)-6-ethoxypyridine-3-sulfonamide
SMILESCCOc1ccc(S(=O)(=O)Nc2onc(C3CCCCC3)c2C)cn1
InChIInChI=1S/C17H23N3O4S/c1-3-23-15-10-9-14(11-18-15)25(21,22)20-17-12(2)16(19-24-17)13-7-5-4-6-8-13/h9-11,13,20H,3-8H2,1-2H3
InChIKeyXVZQRSVAKAXYQD-UHFFFAOYSA-N
MW365.46 g/mol
LogP3.63
Rot. Bonds6

About N-(3-cyclohexyl-4-methyl-1,2-oxazol-5-yl)-6-ethoxypyridine-3-sulfonamide

N-(3-cyclohexyl-4-methyl-1,2-oxazol-5-yl)-6-ethoxypyridine-3-sulfonamide (PubChem CID 126816285) has the molecular formula C17H23N3O4S and a molecular weight of 365.46 g/mol. Its IUPAC name is N-(3-cyclohexyl-4-methyl-1,2-oxazol-5-yl)-6-ethoxypyridine-3-sulfonamide.

Molecular Properties

Compound NameN-(3-cyclohexyl-4-methyl-1,2-oxazol-5-yl)-6-ethoxypyridine-3-sulfonamide
PubChem CID126816285
Molecular FormulaC17H23N3O4S
Molecular Weight365.46 g/mol
Exact Mass365.14
IUPAC NameN-(3-cyclohexyl-4-methyl-1,2-oxazol-5-yl)-6-ethoxypyridine-3-sulfonamide
SMILESCCOc1ccc(S(=O)(=O)Nc2onc(C3CCCCC3)c2C)cn1
InChIInChI=1S/C17H23N3O4S/c1-3-23-15-10-9-14(11-18-15)25(21,22)20-17-12(2)16(19-24-17)13-7-5-4-6-8-13/h9-11,13,20H,3-8H2,1-2H3
InChIKeyXVZQRSVAKAXYQD-UHFFFAOYSA-N
XLogP3.63
TPSA94.32 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.46
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[(1R)-1-[4-(2-methoxy-3-pyridinyl)phenyl]ethyl]-3,5-dimethyl-1,2-oxazole-4-sulfonamide
CID 53316852
N-[(1R)-1-[4-[2-(difluoromethoxy)-3-pyridinyl]phenyl]ethyl]-3,5-dimethyl-1,2-oxazole-4-sulfonamide
CID 53318166
Cyclopropanesulfonic acid methyl-[6-(5-methyl-3-phenyl-isoxazol-4-ylmethoxy)-pyridine-3-carbonyl]-amide
CID 42629932
2-(5-Methyl-3-phenyl-isoxazol-4-ylmethoxy)-5-methylsulfanyl-pyridine
CID 42630047
5-Methanesulfinyl-2-(5-methyl-3-phenyl-isoxazol-4-ylmethoxy)-pyridine
CID 57520475
Butane-1-sulfonic acid [6-(5-methyl-3-phenyl-isoxazol-4-ylmethoxy)-pyridine-3-carbonyl]-amide
CID 86630911
N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-[4-(6-methoxy-2-pyridinyl)phenyl]benzenesulfonamide
CID 18660524
2-(4-Ethoxyphenyl)-N-[3-(pyridin-3-YL)-1,2-oxazol-5-YL]acetamide
CID 53143056
2-fluoro-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzenesulfonamide
CID 53143380
3,5-Dimethyl-4-((4-((5-(trifluoromethyl)pyridin-2-yl)oxy)piperidin-1-yl)sulfonyl)isoxazole
CID 71798795
N-[(6-methoxy-3-pyridinyl)methyl]-3,5-dimethyl-1,2-oxazole-4-sulfonamide
CID 75459964
2-(2-methoxyethoxy)-N-(4,5,6,7-tetrahydrobenzo[c]isoxazol-3-yl)isonicotinamide
CID 119100091

Frequently Asked Questions

What is the IUPAC name of N-(3-cyclohexyl-4-methyl-1,2-oxazol-5-yl)-6-ethoxypyridine-3-sulfonamide?
The IUPAC name of N-(3-cyclohexyl-4-methyl-1,2-oxazol-5-yl)-6-ethoxypyridine-3-sulfonamide (CID 126816285) is N-(3-cyclohexyl-4-methyl-1,2-oxazol-5-yl)-6-ethoxypyridine-3-sulfonamide.
What is the SMILES notation for N-(3-cyclohexyl-4-methyl-1,2-oxazol-5-yl)-6-ethoxypyridine-3-sulfonamide?
The canonical SMILES for N-(3-cyclohexyl-4-methyl-1,2-oxazol-5-yl)-6-ethoxypyridine-3-sulfonamide is CCOc1ccc(S(=O)(=O)Nc2onc(C3CCCCC3)c2C)cn1.
What is the InChIKey of N-(3-cyclohexyl-4-methyl-1,2-oxazol-5-yl)-6-ethoxypyridine-3-sulfonamide?
The InChIKey is XVZQRSVAKAXYQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O4S/c1-3-23-15-10-9-14(11-18-15)25(21,22)20-17-12(2)16(19-24-17)13-7-5-4-6-8-13/h9-11,13,20H,3-8H2,1-2H3.
What are the key properties of N-(3-cyclohexyl-4-methyl-1,2-oxazol-5-yl)-6-ethoxypyridine-3-sulfonamide?
N-(3-cyclohexyl-4-methyl-1,2-oxazol-5-yl)-6-ethoxypyridine-3-sulfonamide has a molecular weight of 365.46 g/mol, XLogP of 3.63, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyclohexyl-4-methyl-1,2-oxazol-5-yl)-6-ethoxypyridine-3-sulfonamide is sourced from PubChem (CID 126816285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).