5-(2-ethylmorpholin-4-yl)sulfonyl-N-methylpyrimidin-2-amine

C11H18N4O3S — CID 62146813

IUPAC5-(2-ethylmorpholin-4-yl)sulfonyl-N-methylpyrimidin-2-amine
SMILESCCC1CN(S(=O)(=O)c2cnc(NC)nc2)CCO1
InChIInChI=1S/C11H18N4O3S/c1-3-9-8-15(4-5-18-9)19(16,17)10-6-13-11(12-2)14-7-10/h6-7,9H,3-5,8H2,1-2H3,(H,12,13,14)
InChIKeyNJSGROJVRLEPIF-UHFFFAOYSA-N
MW286.36 g/mol
LogP0.32
Rot. Bonds4

About 5-(2-ethylmorpholin-4-yl)sulfonyl-N-methylpyrimidin-2-amine

5-(2-ethylmorpholin-4-yl)sulfonyl-N-methylpyrimidin-2-amine (PubChem CID 62146813) has the molecular formula C11H18N4O3S and a molecular weight of 286.36 g/mol. Its IUPAC name is 5-(2-ethylmorpholin-4-yl)sulfonyl-N-methylpyrimidin-2-amine.

Molecular Properties

Compound Name5-(2-ethylmorpholin-4-yl)sulfonyl-N-methylpyrimidin-2-amine
PubChem CID62146813
Molecular FormulaC11H18N4O3S
Molecular Weight286.36 g/mol
Exact Mass286.11
IUPAC Name5-(2-ethylmorpholin-4-yl)sulfonyl-N-methylpyrimidin-2-amine
SMILESCCC1CN(S(=O)(=O)c2cnc(NC)nc2)CCO1
InChIInChI=1S/C11H18N4O3S/c1-3-9-8-15(4-5-18-9)19(16,17)10-6-13-11(12-2)14-7-10/h6-7,9H,3-5,8H2,1-2H3,(H,12,13,14)
InChIKeyNJSGROJVRLEPIF-UHFFFAOYSA-N
XLogP0.32
TPSA84.42 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.36
LogP ≤ 50.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-(2-chloropyrimidin-5-yl)sulfonyl-2-ethylmorpholine
CID 43562747
5-(2-ethylmorpholin-4-yl)sulfonylpyrimidin-2-amine
CID 62147516
5-(3-ethylpyrrolidin-1-yl)sulfonyl-N-methylpyrimidin-2-amine
CID 113418709
4-[(5,6-dichloro-3-pyridinyl)sulfonyl]-2-ethylmorpholine
CID 64623353
5-(2-ethylmorpholin-4-yl)sulfonyl-N-propylpyridin-2-amine
CID 62146457
5-(2-ethylmorpholin-4-yl)sulfonylpyridine-2-carbothioamide
CID 114614163
4-[(2-chloro-1,3-thiazol-5-yl)sulfonyl]-2-ethylmorpholine
CID 43562749
[5-(2-methylmorpholin-4-yl)sulfonylpyrimidin-2-yl]hydrazine
CID 61328325
5-(2,3,4a,5,6,7,8,8a-octahydrobenzo[b][1,4]oxazin-4-ylsulfonyl)-N-methylpyrimidin-2-amine
CID 62152943
5-(3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazin-4-ylsulfonyl)-N-methylpyrimidin-2-amine
CID 62158231
5-(2-ethylpyrrolidin-1-yl)sulfonyl-N-methylpyrimidin-2-amine
CID 62164699
3-(2-ethylmorpholin-4-yl)sulfonylaniline
CID 43562350

Frequently Asked Questions

What is the IUPAC name of 5-(2-ethylmorpholin-4-yl)sulfonyl-N-methylpyrimidin-2-amine?
The IUPAC name of 5-(2-ethylmorpholin-4-yl)sulfonyl-N-methylpyrimidin-2-amine (CID 62146813) is 5-(2-ethylmorpholin-4-yl)sulfonyl-N-methylpyrimidin-2-amine.
What is the SMILES notation for 5-(2-ethylmorpholin-4-yl)sulfonyl-N-methylpyrimidin-2-amine?
The canonical SMILES for 5-(2-ethylmorpholin-4-yl)sulfonyl-N-methylpyrimidin-2-amine is CCC1CN(S(=O)(=O)c2cnc(NC)nc2)CCO1.
What is the InChIKey of 5-(2-ethylmorpholin-4-yl)sulfonyl-N-methylpyrimidin-2-amine?
The InChIKey is NJSGROJVRLEPIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O3S/c1-3-9-8-15(4-5-18-9)19(16,17)10-6-13-11(12-2)14-7-10/h6-7,9H,3-5,8H2,1-2H3,(H,12,13,14).
What are the key properties of 5-(2-ethylmorpholin-4-yl)sulfonyl-N-methylpyrimidin-2-amine?
5-(2-ethylmorpholin-4-yl)sulfonyl-N-methylpyrimidin-2-amine has a molecular weight of 286.36 g/mol, XLogP of 0.32, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-ethylmorpholin-4-yl)sulfonyl-N-methylpyrimidin-2-amine is sourced from PubChem (CID 62146813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).