(2R)-2-(2,6-dimethylpyrimidin-4-yl)-4-(thiophen-3-ylmethyl)morpholine

C15H19N3OS — CID 124953952

IUPAC(2R)-2-(2,6-dimethylpyrimidin-4-yl)-4-(thiophen-3-ylmethyl)morpholine
SMILESCc1cc([C@H]2CN(Cc3ccsc3)CCO2)nc(C)n1
InChIInChI=1S/C15H19N3OS/c1-11-7-14(17-12(2)16-11)15-9-18(4-5-19-15)8-13-3-6-20-10-13/h3,6-7,10,15H,4-5,8-9H2,1-2H3/t15-/m1/s1
InChIKeyDYYWENMOCFVMMJ-OAHLLOKOSA-N
MW289.40 g/mol
LogP2.73
Rot. Bonds3

About (2R)-2-(2,6-dimethylpyrimidin-4-yl)-4-(thiophen-3-ylmethyl)morpholine

(2R)-2-(2,6-dimethylpyrimidin-4-yl)-4-(thiophen-3-ylmethyl)morpholine (PubChem CID 124953952) has the molecular formula C15H19N3OS and a molecular weight of 289.40 g/mol. Its IUPAC name is (2R)-2-(2,6-dimethylpyrimidin-4-yl)-4-(thiophen-3-ylmethyl)morpholine.

Molecular Properties

Compound Name(2R)-2-(2,6-dimethylpyrimidin-4-yl)-4-(thiophen-3-ylmethyl)morpholine
PubChem CID124953952
Molecular FormulaC15H19N3OS
Molecular Weight289.40 g/mol
Exact Mass289.12
IUPAC Name(2R)-2-(2,6-dimethylpyrimidin-4-yl)-4-(thiophen-3-ylmethyl)morpholine
SMILESCc1cc([C@H]2CN(Cc3ccsc3)CCO2)nc(C)n1
InChIInChI=1S/C15H19N3OS/c1-11-7-14(17-12(2)16-11)15-9-18(4-5-19-15)8-13-3-6-20-10-13/h3,6-7,10,15H,4-5,8-9H2,1-2H3/t15-/m1/s1
InChIKeyDYYWENMOCFVMMJ-OAHLLOKOSA-N
XLogP2.73
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.40
LogP ≤ 52.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-methyl-6-[4-(thiophen-3-ylmethyl)morpholin-2-yl]pyridin-4-amine
CID 110113414
4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-2-(2,6-dimethylpyrimidin-4-yl)morpholine
CID 110115909
2-(2,6-dimethylpyrimidin-4-yl)-4-(1,3-thiazol-2-ylmethyl)morpholine
CID 110115917
2-(2,6-dimethylpyrimidin-4-yl)-4-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholine
CID 110115918
2-(2,6-dimethylpyrimidin-4-yl)-4-(quinolin-6-ylmethyl)morpholine
CID 110115969
(2R)-2-(2,6-dimethylpyrimidin-4-yl)-4-(1H-pyrazol-5-ylmethyl)morpholine
CID 125024565
2-(2,6-dimethylpyrimidin-4-yl)-4-[(2-pyrrolidin-1-ylpyrimidin-4-yl)methyl]morpholine
CID 110115987
2-(2,6-dimethylpyrimidin-4-yl)-4-(4,6-dimethylpyrimidin-2-yl)morpholine
CID 110115953
(5aS,8aS)-7-[(4-methyl-1,3-thiazol-5-yl)methyl]-4-(thiophen-3-ylmethyl)-3,5,5a,6,8,8a-hexahydro-2H-pyrrolo[3,4-f][1,4]oxazepine
CID 97475501
4-methyl-2-[(3S)-1-(thiophen-3-ylmethyl)pyrrolidin-3-yl]pyrimidine
CID 129406988
N,N,2-trimethyl-6-[(2R)-4-[(6-methyl-3-pyridinyl)methyl]morpholin-2-yl]pyridin-4-amine
CID 124990677
6-[4-(1H-indol-5-ylmethyl)morpholin-2-yl]-N,2-dimethylpyrimidin-4-amine
CID 110271900

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2,6-dimethylpyrimidin-4-yl)-4-(thiophen-3-ylmethyl)morpholine?
The IUPAC name of (2R)-2-(2,6-dimethylpyrimidin-4-yl)-4-(thiophen-3-ylmethyl)morpholine (CID 124953952) is (2R)-2-(2,6-dimethylpyrimidin-4-yl)-4-(thiophen-3-ylmethyl)morpholine.
What is the SMILES notation for (2R)-2-(2,6-dimethylpyrimidin-4-yl)-4-(thiophen-3-ylmethyl)morpholine?
The canonical SMILES for (2R)-2-(2,6-dimethylpyrimidin-4-yl)-4-(thiophen-3-ylmethyl)morpholine is Cc1cc([C@H]2CN(Cc3ccsc3)CCO2)nc(C)n1.
What is the InChIKey of (2R)-2-(2,6-dimethylpyrimidin-4-yl)-4-(thiophen-3-ylmethyl)morpholine?
The InChIKey is DYYWENMOCFVMMJ-OAHLLOKOSA-N. The full InChI is InChI=1S/C15H19N3OS/c1-11-7-14(17-12(2)16-11)15-9-18(4-5-19-15)8-13-3-6-20-10-13/h3,6-7,10,15H,4-5,8-9H2,1-2H3/t15-/m1/s1.
What are the key properties of (2R)-2-(2,6-dimethylpyrimidin-4-yl)-4-(thiophen-3-ylmethyl)morpholine?
(2R)-2-(2,6-dimethylpyrimidin-4-yl)-4-(thiophen-3-ylmethyl)morpholine has a molecular weight of 289.40 g/mol, XLogP of 2.73, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2,6-dimethylpyrimidin-4-yl)-4-(thiophen-3-ylmethyl)morpholine is sourced from PubChem (CID 124953952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).