N-methyl-2-[N-methylsulfonyl-4-(morpholine-4-carbonyl)anilino]acetamide

C15H21N3O5S — CID 30255255

IUPACN-methyl-2-[N-methylsulfonyl-4-(morpholine-4-carbonyl)anilino]acetamide
SMILESCNC(=O)CN(c1ccc(C(=O)N2CCOCC2)cc1)S(C)(=O)=O
InChIInChI=1S/C15H21N3O5S/c1-16-14(19)11-18(24(2,21)22)13-5-3-12(4-6-13)15(20)17-7-9-23-10-8-17/h3-6H,7-11H2,1-2H3,(H,16,19)
InChIKeyOHXZXGXNUVMQPM-UHFFFAOYSA-N
MW355.42 g/mol
LogP-0.33
Rot. Bonds5

About N-methyl-2-[N-methylsulfonyl-4-(morpholine-4-carbonyl)anilino]acetamide

N-methyl-2-[N-methylsulfonyl-4-(morpholine-4-carbonyl)anilino]acetamide (PubChem CID 30255255) has the molecular formula C15H21N3O5S and a molecular weight of 355.42 g/mol. Its IUPAC name is N-methyl-2-[N-methylsulfonyl-4-(morpholine-4-carbonyl)anilino]acetamide.

Molecular Properties

Compound NameN-methyl-2-[N-methylsulfonyl-4-(morpholine-4-carbonyl)anilino]acetamide
PubChem CID30255255
Molecular FormulaC15H21N3O5S
Molecular Weight355.42 g/mol
Exact Mass355.12
IUPAC NameN-methyl-2-[N-methylsulfonyl-4-(morpholine-4-carbonyl)anilino]acetamide
SMILESCNC(=O)CN(c1ccc(C(=O)N2CCOCC2)cc1)S(C)(=O)=O
InChIInChI=1S/C15H21N3O5S/c1-16-14(19)11-18(24(2,21)22)13-5-3-12(4-6-13)15(20)17-7-9-23-10-8-17/h3-6H,7-11H2,1-2H3,(H,16,19)
InChIKeyOHXZXGXNUVMQPM-UHFFFAOYSA-N
XLogP-0.33
TPSA96.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.42
LogP ≤ 5-0.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[N-methylsulfonyl-4-(morpholine-4-carbonyl)anilino]acetamide?
The IUPAC name of N-methyl-2-[N-methylsulfonyl-4-(morpholine-4-carbonyl)anilino]acetamide (CID 30255255) is N-methyl-2-[N-methylsulfonyl-4-(morpholine-4-carbonyl)anilino]acetamide.
What is the SMILES notation for N-methyl-2-[N-methylsulfonyl-4-(morpholine-4-carbonyl)anilino]acetamide?
The canonical SMILES for N-methyl-2-[N-methylsulfonyl-4-(morpholine-4-carbonyl)anilino]acetamide is CNC(=O)CN(c1ccc(C(=O)N2CCOCC2)cc1)S(C)(=O)=O.
What is the InChIKey of N-methyl-2-[N-methylsulfonyl-4-(morpholine-4-carbonyl)anilino]acetamide?
The InChIKey is OHXZXGXNUVMQPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O5S/c1-16-14(19)11-18(24(2,21)22)13-5-3-12(4-6-13)15(20)17-7-9-23-10-8-17/h3-6H,7-11H2,1-2H3,(H,16,19).
What are the key properties of N-methyl-2-[N-methylsulfonyl-4-(morpholine-4-carbonyl)anilino]acetamide?
N-methyl-2-[N-methylsulfonyl-4-(morpholine-4-carbonyl)anilino]acetamide has a molecular weight of 355.42 g/mol, XLogP of -0.33, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[N-methylsulfonyl-4-(morpholine-4-carbonyl)anilino]acetamide is sourced from PubChem (CID 30255255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).