N-(4-methyl-2-morpholin-4-ylpentyl)-2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetamide

C20H29N3O3S — CID 55547756

IUPACN-(4-methyl-2-morpholin-4-ylpentyl)-2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetamide
SMILESCC(C)CC(CNC(=O)CC1Sc2ccccc2NC1=O)N1CCOCC1
InChIInChI=1S/C20H29N3O3S/c1-14(2)11-15(23-7-9-26-10-8-23)13-21-19(24)12-18-20(25)22-16-5-3-4-6-17(16)27-18/h3-6,14-15,18H,7-13H2,1-2H3,(H,21,24)(H,22,25)
InChIKeyKZIBQTRVMSYTJL-UHFFFAOYSA-N
MW391.54 g/mol
LogP2.35
Rot. Bonds7

About N-(4-methyl-2-morpholin-4-ylpentyl)-2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetamide

N-(4-methyl-2-morpholin-4-ylpentyl)-2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetamide (PubChem CID 55547756) has the molecular formula C20H29N3O3S and a molecular weight of 391.54 g/mol. Its IUPAC name is N-(4-methyl-2-morpholin-4-ylpentyl)-2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetamide.

Molecular Properties

Compound NameN-(4-methyl-2-morpholin-4-ylpentyl)-2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetamide
PubChem CID55547756
Molecular FormulaC20H29N3O3S
Molecular Weight391.54 g/mol
Exact Mass391.19
IUPAC NameN-(4-methyl-2-morpholin-4-ylpentyl)-2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetamide
SMILESCC(C)CC(CNC(=O)CC1Sc2ccccc2NC1=O)N1CCOCC1
InChIInChI=1S/C20H29N3O3S/c1-14(2)11-15(23-7-9-26-10-8-23)13-21-19(24)12-18-20(25)22-16-5-3-4-6-17(16)27-18/h3-6,14-15,18H,7-13H2,1-2H3,(H,21,24)(H,22,25)
InChIKeyKZIBQTRVMSYTJL-UHFFFAOYSA-N
XLogP2.35
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.54
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-(4-methyl-2-morpholin-4-ylpentyl)-2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(6-chloro-3-oxo-4H-1,4-benzothiazin-2-yl)-N-(4-methyl-2-morpholin-4-ylpentyl)acetamide
CID 24633693
N-(2-methyl-3-piperidin-1-ylpropyl)-2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetamide
CID 55948234
N-ethyl-2-[(2S)-3-oxo-4H-1,4-benzothiazin-2-yl]acetamide
CID 729474
N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-2-[(2S)-3-oxo-4H-1,4-benzothiazin-2-yl]acetamide
CID 40820600
N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetamide
CID 55584393
2-[(2S)-3-oxo-4H-1,4-benzothiazin-2-yl]-N-[(2R)-2-phenylbutyl]acetamide
CID 25397114
N-[(5-morpholin-4-ylsulfonylthiophen-2-yl)methyl]-2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetamide
CID 42928706
N-(4-methyl-2-morpholin-4-ylpentyl)-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide
CID 134027214
N-[2-(ethylamino)-2-oxoethyl]-2-[(2R)-3-oxo-4H-1,4-benzothiazin-2-yl]acetamide
CID 9224548
2-[(2R)-3-oxo-4H-1,4-benzothiazin-2-yl]-N-piperidin-1-ylacetamide
CID 9271504
N-(4-methyl-2-morpholin-4-ylpentyl)-2-pyrrolidin-2-ylacetamide
CID 61363910
N-[4-(2-morpholin-4-ylethyl)phenyl]-2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetamide
CID 55977401

Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-2-morpholin-4-ylpentyl)-2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetamide?
The IUPAC name of N-(4-methyl-2-morpholin-4-ylpentyl)-2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetamide (CID 55547756) is N-(4-methyl-2-morpholin-4-ylpentyl)-2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetamide.
What is the SMILES notation for N-(4-methyl-2-morpholin-4-ylpentyl)-2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetamide?
The canonical SMILES for N-(4-methyl-2-morpholin-4-ylpentyl)-2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetamide is CC(C)CC(CNC(=O)CC1Sc2ccccc2NC1=O)N1CCOCC1.
What is the InChIKey of N-(4-methyl-2-morpholin-4-ylpentyl)-2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetamide?
The InChIKey is KZIBQTRVMSYTJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H29N3O3S/c1-14(2)11-15(23-7-9-26-10-8-23)13-21-19(24)12-18-20(25)22-16-5-3-4-6-17(16)27-18/h3-6,14-15,18H,7-13H2,1-2H3,(H,21,24)(H,22,25).
What are the key properties of N-(4-methyl-2-morpholin-4-ylpentyl)-2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetamide?
N-(4-methyl-2-morpholin-4-ylpentyl)-2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetamide has a molecular weight of 391.54 g/mol, XLogP of 2.35, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-2-morpholin-4-ylpentyl)-2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetamide is sourced from PubChem (CID 55547756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).