N,N-dimethyl-4-(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)piperazine-1-sulfonamide

C15H26N6O3S — CID 50947311

IUPACN,N-dimethyl-4-(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)piperazine-1-sulfonamide
SMILESCc1cc(N2CCN(S(=O)(=O)N(C)C)CC2)nc(N2CCOCC2)n1
InChIInChI=1S/C15H26N6O3S/c1-13-12-14(17-15(16-13)20-8-10-24-11-9-20)19-4-6-21(7-5-19)25(22,23)18(2)3/h12H,4-11H2,1-3H3
InChIKeyVEPJLZJVLLDQIY-UHFFFAOYSA-N
MW370.48 g/mol
LogP-0.45
Rot. Bonds4

About N,N-dimethyl-4-(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)piperazine-1-sulfonamide

N,N-dimethyl-4-(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)piperazine-1-sulfonamide (PubChem CID 50947311) has the molecular formula C15H26N6O3S and a molecular weight of 370.48 g/mol. Its IUPAC name is N,N-dimethyl-4-(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)piperazine-1-sulfonamide.

Molecular Properties

Compound NameN,N-dimethyl-4-(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)piperazine-1-sulfonamide
PubChem CID50947311
Molecular FormulaC15H26N6O3S
Molecular Weight370.48 g/mol
Exact Mass370.18
IUPAC NameN,N-dimethyl-4-(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)piperazine-1-sulfonamide
SMILESCc1cc(N2CCN(S(=O)(=O)N(C)C)CC2)nc(N2CCOCC2)n1
InChIInChI=1S/C15H26N6O3S/c1-13-12-14(17-15(16-13)20-8-10-24-11-9-20)19-4-6-21(7-5-19)25(22,23)18(2)3/h12H,4-11H2,1-3H3
InChIKeyVEPJLZJVLLDQIY-UHFFFAOYSA-N
XLogP-0.45
TPSA82.11 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.48
LogP ≤ 5-0.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

4-[2-(4-ethylsulfonylpiperazin-1-yl)-6-methylpyrimidin-4-yl]morpholine
CID 27656202
4-[4-methyl-6-(4-propylsulfonylpiperazin-1-yl)pyrimidin-2-yl]morpholine
CID 50947472
4-[2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-6-methylpyrimidin-4-yl]morpholine
CID 44826823
4-[4-[4-(1H-imidazol-5-ylsulfonyl)piperazin-1-yl]-6-methylpyrimidin-2-yl]morpholine
CID 122340139
4-[4-methyl-6-(4-pyridin-3-ylsulfonylpiperazin-1-yl)pyrimidin-2-yl]morpholine
CID 50945868
4-[4-[4-(4-fluoro-2-methylphenyl)sulfonylpiperazin-1-yl]-6-methylpyrimidin-2-yl]morpholine
CID 122340159
4-[6-methyl-2-[4-[(3-methylphenyl)methylsulfonyl]piperazin-1-yl]pyrimidin-4-yl]morpholine
CID 122333660
4-[4-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-6-methylpyrimidin-2-yl]morpholine
CID 50947561
N,N-dimethyl-4-[4-(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)piperazine-1-carbonyl]benzenesulfonamide
CID 50947593
4-[2-[4-(1-ethyl-2-methylimidazol-4-yl)sulfonylpiperazin-1-yl]-6-methylpyrimidin-4-yl]morpholine
CID 122333697
4-[2-[4-(5-methoxy-2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-6-methylpyrimidin-4-yl]morpholine
CID 27475852
4-[2-[4-(5-ethylthiophen-2-yl)sulfonylpiperazin-1-yl]-6-methylpyrimidin-4-yl]morpholine
CID 122333647

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)piperazine-1-sulfonamide?
The IUPAC name of N,N-dimethyl-4-(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)piperazine-1-sulfonamide (CID 50947311) is N,N-dimethyl-4-(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)piperazine-1-sulfonamide.
What is the SMILES notation for N,N-dimethyl-4-(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)piperazine-1-sulfonamide?
The canonical SMILES for N,N-dimethyl-4-(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)piperazine-1-sulfonamide is Cc1cc(N2CCN(S(=O)(=O)N(C)C)CC2)nc(N2CCOCC2)n1.
What is the InChIKey of N,N-dimethyl-4-(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)piperazine-1-sulfonamide?
The InChIKey is VEPJLZJVLLDQIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N6O3S/c1-13-12-14(17-15(16-13)20-8-10-24-11-9-20)19-4-6-21(7-5-19)25(22,23)18(2)3/h12H,4-11H2,1-3H3.
What are the key properties of N,N-dimethyl-4-(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)piperazine-1-sulfonamide?
N,N-dimethyl-4-(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)piperazine-1-sulfonamide has a molecular weight of 370.48 g/mol, XLogP of -0.45, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)piperazine-1-sulfonamide is sourced from PubChem (CID 50947311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).