N-(2-morpholin-4-ylpyrimidin-5-yl)propane-1-sulfonamide

C11H18N4O3S — CID 71790207

IUPACN-(2-morpholin-4-ylpyrimidin-5-yl)propane-1-sulfonamide
SMILESCCCS(=O)(=O)Nc1cnc(N2CCOCC2)nc1
InChIInChI=1S/C11H18N4O3S/c1-2-7-19(16,17)14-10-8-12-11(13-9-10)15-3-5-18-6-4-15/h8-9,14H,2-7H2,1H3
InChIKeyYTCXDQXAKGMOAD-UHFFFAOYSA-N
MW286.36 g/mol
LogP0.46
Rot. Bonds5

About N-(2-morpholin-4-ylpyrimidin-5-yl)propane-1-sulfonamide

N-(2-morpholin-4-ylpyrimidin-5-yl)propane-1-sulfonamide (PubChem CID 71790207) has the molecular formula C11H18N4O3S and a molecular weight of 286.36 g/mol. Its IUPAC name is N-(2-morpholin-4-ylpyrimidin-5-yl)propane-1-sulfonamide.

Molecular Properties

Compound NameN-(2-morpholin-4-ylpyrimidin-5-yl)propane-1-sulfonamide
PubChem CID71790207
Molecular FormulaC11H18N4O3S
Molecular Weight286.36 g/mol
Exact Mass286.11
IUPAC NameN-(2-morpholin-4-ylpyrimidin-5-yl)propane-1-sulfonamide
SMILESCCCS(=O)(=O)Nc1cnc(N2CCOCC2)nc1
InChIInChI=1S/C11H18N4O3S/c1-2-7-19(16,17)14-10-8-12-11(13-9-10)15-3-5-18-6-4-15/h8-9,14H,2-7H2,1H3
InChIKeyYTCXDQXAKGMOAD-UHFFFAOYSA-N
XLogP0.46
TPSA84.42 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.36
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2-piperidin-1-ylpyrimidin-5-yl)ethanesulfonamide
CID 122298530
N-(6-morpholin-4-yl-3-pyridinyl)ethanesulfonamide
CID 53016560
N-[6-(2-morpholin-4-ylethylamino)-3-pyridinyl]butane-1-sulfonamide
CID 113010893
2-phenoxy-N-[2-(4-phenylpiperazin-1-yl)pyrimidin-5-yl]ethanesulfonamide
CID 122299471
N-[3-fluoro-5-(3-morpholin-4-ylquinoxalin-6-yl)oxyphenyl]propane-1-sulfonamide
CID 71678497
N-[4-(morpholine-4-carbonyl)phenyl]propane-1-sulfonamide
CID 87027248
N-[4-(3-methylmorpholin-4-yl)sulfonylphenyl]propane-1-sulfonamide
CID 110352399
4-ethyl-N-(2-morpholin-4-ylpyrimidin-5-yl)benzamide
CID 53164786
N-[6-(4-piperidin-1-ylanilino)-3-pyridinyl]propane-1-sulfonamide
CID 113021072
N-[3,4-difluoro-5-(3-morpholin-4-ylquinoxaline-6-carbonyl)phenyl]propane-1-sulfonamide
CID 71268676
N-(2-pyrrolidin-1-ylpyrimidin-5-yl)cyclopropanesulfonamide
CID 122298341
N-[5-(4-pyrrolidin-1-ylanilino)-2-pyridinyl]propane-1-sulfonamide
CID 113035669

Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-ylpyrimidin-5-yl)propane-1-sulfonamide?
The IUPAC name of N-(2-morpholin-4-ylpyrimidin-5-yl)propane-1-sulfonamide (CID 71790207) is N-(2-morpholin-4-ylpyrimidin-5-yl)propane-1-sulfonamide.
What is the SMILES notation for N-(2-morpholin-4-ylpyrimidin-5-yl)propane-1-sulfonamide?
The canonical SMILES for N-(2-morpholin-4-ylpyrimidin-5-yl)propane-1-sulfonamide is CCCS(=O)(=O)Nc1cnc(N2CCOCC2)nc1.
What is the InChIKey of N-(2-morpholin-4-ylpyrimidin-5-yl)propane-1-sulfonamide?
The InChIKey is YTCXDQXAKGMOAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O3S/c1-2-7-19(16,17)14-10-8-12-11(13-9-10)15-3-5-18-6-4-15/h8-9,14H,2-7H2,1H3.
What are the key properties of N-(2-morpholin-4-ylpyrimidin-5-yl)propane-1-sulfonamide?
N-(2-morpholin-4-ylpyrimidin-5-yl)propane-1-sulfonamide has a molecular weight of 286.36 g/mol, XLogP of 0.46, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-ylpyrimidin-5-yl)propane-1-sulfonamide is sourced from PubChem (CID 71790207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).