N,N-dimethyl-2-(6-morpholin-4-ylsulfonyl-2-oxo-1,3-benzoxazol-3-yl)acetamide

C15H19N3O6S — CID 19259985

IUPACN,N-dimethyl-2-(6-morpholin-4-ylsulfonyl-2-oxo-1,3-benzoxazol-3-yl)acetamide
SMILESCN(C)C(=O)Cn1c(=O)oc2cc(S(=O)(=O)N3CCOCC3)ccc21
InChIInChI=1S/C15H19N3O6S/c1-16(2)14(19)10-18-12-4-3-11(9-13(12)24-15(18)20)25(21,22)17-5-7-23-8-6-17/h3-4,9H,5-8,10H2,1-2H3
InChIKeyIBSUTUYQPLKBJX-UHFFFAOYSA-N
MW369.40 g/mol
LogP-0.30
Rot. Bonds4

About N,N-dimethyl-2-(6-morpholin-4-ylsulfonyl-2-oxo-1,3-benzoxazol-3-yl)acetamide

N,N-dimethyl-2-(6-morpholin-4-ylsulfonyl-2-oxo-1,3-benzoxazol-3-yl)acetamide (PubChem CID 19259985) has the molecular formula C15H19N3O6S and a molecular weight of 369.40 g/mol. Its IUPAC name is N,N-dimethyl-2-(6-morpholin-4-ylsulfonyl-2-oxo-1,3-benzoxazol-3-yl)acetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-(6-morpholin-4-ylsulfonyl-2-oxo-1,3-benzoxazol-3-yl)acetamide
PubChem CID19259985
Molecular FormulaC15H19N3O6S
Molecular Weight369.40 g/mol
Exact Mass369.10
IUPAC NameN,N-dimethyl-2-(6-morpholin-4-ylsulfonyl-2-oxo-1,3-benzoxazol-3-yl)acetamide
SMILESCN(C)C(=O)Cn1c(=O)oc2cc(S(=O)(=O)N3CCOCC3)ccc21
InChIInChI=1S/C15H19N3O6S/c1-16(2)14(19)10-18-12-4-3-11(9-13(12)24-15(18)20)25(21,22)17-5-7-23-8-6-17/h3-4,9H,5-8,10H2,1-2H3
InChIKeyIBSUTUYQPLKBJX-UHFFFAOYSA-N
XLogP-0.30
TPSA102.06 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.40
LogP ≤ 5-0.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

3-(2-morpholin-4-yl-2-oxoethyl)-6-pyrrolidin-1-ylsulfonyl-1,3-benzoxazol-2-one
CID 19259995
6-morpholin-4-ylsulfonyl-3-[2-(4-nitrophenyl)-2-oxoethyl]-1,3-benzoxazol-2-one
CID 19259809
N-(4-ethylphenyl)-2-(6-morpholin-4-ylsulfonyl-2-oxo-1,3-benzoxazol-3-yl)acetamide
CID 5307802
N-cyclooctyl-2-(6-morpholin-4-ylsulfonyl-2-oxo-1,3-benzoxazol-3-yl)acetamide
CID 20876154
N-(4-methoxyphenyl)-2-(6-morpholin-4-ylsulfonyl-2-oxo-1,3-benzoxazol-3-yl)acetamide
CID 19260112
2-(6-morpholin-4-ylsulfonyl-2-oxo-1,3-benzoxazol-3-yl)-N-(4-propan-2-ylphenyl)acetamide
CID 20876158
3-benzyl-6-morpholin-4-ylsulfonyl-1,3-benzoxazol-2-one
CID 19259782
ethyl 2-(2-oxo-6-pyrrolidin-1-ylsulfonyl-1,3-benzoxazol-3-yl)acetate
CID 6622485
3-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]-6-morpholin-4-ylsulfonyl-1,3-benzoxazol-2-one
CID 53298160
2-[6-(azepan-1-ylsulfonyl)-2-oxo-1,3-benzoxazol-3-yl]acetic acid
CID 3672745
6-(azepan-1-ylsulfonyl)-3-(2-oxo-2-piperidin-1-ylethyl)-1,3-benzoxazol-2-one
CID 19260010
methyl 2-[6-(4-methylpiperazin-1-yl)sulfonyl-2-oxo-1,3-benzoxazol-3-yl]acetate
CID 53051867

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-(6-morpholin-4-ylsulfonyl-2-oxo-1,3-benzoxazol-3-yl)acetamide?
The IUPAC name of N,N-dimethyl-2-(6-morpholin-4-ylsulfonyl-2-oxo-1,3-benzoxazol-3-yl)acetamide (CID 19259985) is N,N-dimethyl-2-(6-morpholin-4-ylsulfonyl-2-oxo-1,3-benzoxazol-3-yl)acetamide.
What is the SMILES notation for N,N-dimethyl-2-(6-morpholin-4-ylsulfonyl-2-oxo-1,3-benzoxazol-3-yl)acetamide?
The canonical SMILES for N,N-dimethyl-2-(6-morpholin-4-ylsulfonyl-2-oxo-1,3-benzoxazol-3-yl)acetamide is CN(C)C(=O)Cn1c(=O)oc2cc(S(=O)(=O)N3CCOCC3)ccc21.
What is the InChIKey of N,N-dimethyl-2-(6-morpholin-4-ylsulfonyl-2-oxo-1,3-benzoxazol-3-yl)acetamide?
The InChIKey is IBSUTUYQPLKBJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O6S/c1-16(2)14(19)10-18-12-4-3-11(9-13(12)24-15(18)20)25(21,22)17-5-7-23-8-6-17/h3-4,9H,5-8,10H2,1-2H3.
What are the key properties of N,N-dimethyl-2-(6-morpholin-4-ylsulfonyl-2-oxo-1,3-benzoxazol-3-yl)acetamide?
N,N-dimethyl-2-(6-morpholin-4-ylsulfonyl-2-oxo-1,3-benzoxazol-3-yl)acetamide has a molecular weight of 369.40 g/mol, XLogP of -0.30, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(6-morpholin-4-ylsulfonyl-2-oxo-1,3-benzoxazol-3-yl)acetamide is sourced from PubChem (CID 19259985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).