4-[4-[(dimethylsulfamoylamino)methyl]pyrimidin-2-yl]morpholine

C11H19N5O3S — CID 122353348

IUPAC4-[4-[(dimethylsulfamoylamino)methyl]pyrimidin-2-yl]morpholine
SMILESCN(C)S(=O)(=O)NCc1ccnc(N2CCOCC2)n1
InChIInChI=1S/C11H19N5O3S/c1-15(2)20(17,18)13-9-10-3-4-12-11(14-10)16-5-7-19-8-6-16/h3-4,13H,5-9H2,1-2H3
InChIKeyXHXQDTOLXRPHNU-UHFFFAOYSA-N
MW301.37 g/mol
LogP-0.79
Rot. Bonds5

About 4-[4-[(dimethylsulfamoylamino)methyl]pyrimidin-2-yl]morpholine

4-[4-[(dimethylsulfamoylamino)methyl]pyrimidin-2-yl]morpholine (PubChem CID 122353348) has the molecular formula C11H19N5O3S and a molecular weight of 301.37 g/mol. Its IUPAC name is 4-[4-[(dimethylsulfamoylamino)methyl]pyrimidin-2-yl]morpholine.

Molecular Properties

Compound Name4-[4-[(dimethylsulfamoylamino)methyl]pyrimidin-2-yl]morpholine
PubChem CID122353348
Molecular FormulaC11H19N5O3S
Molecular Weight301.37 g/mol
Exact Mass301.12
IUPAC Name4-[4-[(dimethylsulfamoylamino)methyl]pyrimidin-2-yl]morpholine
SMILESCN(C)S(=O)(=O)NCc1ccnc(N2CCOCC2)n1
InChIInChI=1S/C11H19N5O3S/c1-15(2)20(17,18)13-9-10-3-4-12-11(14-10)16-5-7-19-8-6-16/h3-4,13H,5-9H2,1-2H3
InChIKeyXHXQDTOLXRPHNU-UHFFFAOYSA-N
XLogP-0.79
TPSA87.66 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.37
LogP ≤ 5-0.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-[4-[(dimethylsulfamoylamino)methyl]pyrimidin-2-yl]morpholine 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

5-ethyl-N-[(2-morpholin-4-ylpyrimidin-4-yl)methyl]thiophene-2-sulfonamide
CID 122353531
N,N-dimethyl-4-[(2-morpholin-4-ylpyrimidin-4-yl)methyl]piperazine-1-sulfonamide
CID 92606666
2-(dimethylamino)-4-[(dimethylsulfamoylamino)methyl]pyrimidine
CID 122354229
N-[(2-piperidin-1-ylpyrimidin-4-yl)methyl]methanesulfonamide
CID 122353047
2,5-dichloro-N-[(2-morpholin-4-ylpyrimidin-4-yl)methyl]benzenesulfonamide
CID 91967427
2-cyano-N-[(2-morpholin-4-ylpyrimidin-4-yl)methyl]benzenesulfonamide
CID 122353594
1-ethyl-3,5-dimethyl-N-[(2-morpholin-4-ylpyrimidin-4-yl)methyl]pyrazole-4-sulfonamide
CID 122353575
2-ethyl-N-[(2-morpholin-4-ylpyrimidin-4-yl)methyl]butanamide
CID 122353332
3-methyl-N-[(2-morpholin-4-ylpyrimidin-4-yl)methyl]-2-oxo-1,3-benzoxazole-5-sulfonamide
CID 122353565
4-[4-(chloromethyl)pyrimidin-2-yl]morpholine
CID 62747047
N-[(2-piperidin-1-ylpyrimidin-4-yl)methyl]pyrrolidine-1-sulfonamide
CID 122353302
1-phenyl-N-[(2-pyrrolidin-1-ylpyrimidin-4-yl)methyl]methanesulfonamide
CID 91967200

Frequently Asked Questions

What is the IUPAC name of 4-[4-[(dimethylsulfamoylamino)methyl]pyrimidin-2-yl]morpholine?
The IUPAC name of 4-[4-[(dimethylsulfamoylamino)methyl]pyrimidin-2-yl]morpholine (CID 122353348) is 4-[4-[(dimethylsulfamoylamino)methyl]pyrimidin-2-yl]morpholine.
What is the SMILES notation for 4-[4-[(dimethylsulfamoylamino)methyl]pyrimidin-2-yl]morpholine?
The canonical SMILES for 4-[4-[(dimethylsulfamoylamino)methyl]pyrimidin-2-yl]morpholine is CN(C)S(=O)(=O)NCc1ccnc(N2CCOCC2)n1.
What is the InChIKey of 4-[4-[(dimethylsulfamoylamino)methyl]pyrimidin-2-yl]morpholine?
The InChIKey is XHXQDTOLXRPHNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5O3S/c1-15(2)20(17,18)13-9-10-3-4-12-11(14-10)16-5-7-19-8-6-16/h3-4,13H,5-9H2,1-2H3.
What are the key properties of 4-[4-[(dimethylsulfamoylamino)methyl]pyrimidin-2-yl]morpholine?
4-[4-[(dimethylsulfamoylamino)methyl]pyrimidin-2-yl]morpholine has a molecular weight of 301.37 g/mol, XLogP of -0.79, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-[(dimethylsulfamoylamino)methyl]pyrimidin-2-yl]morpholine is sourced from PubChem (CID 122353348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).