(2R,6R)-N-[2-(2-cyclopropylpyrimidin-5-yl)ethyl]-2-methyl-6-(3-methyl-1,2,4-oxadiazol-5-yl)morpholine-4-carboxamide

C18H24N6O3 — CID 126825314

IUPAC(2R,6R)-N-[2-(2-cyclopropylpyrimidin-5-yl)ethyl]-2-methyl-6-(3-methyl-1,2,4-oxadiazol-5-yl)morpholine-4-carboxamide
SMILESCc1noc([C@H]2CN(C(=O)NCCc3cnc(C4CC4)nc3)C[C@@H](C)O2)n1
InChIInChI=1S/C18H24N6O3/c1-11-9-24(10-15(26-11)17-22-12(2)23-27-17)18(25)19-6-5-13-7-20-16(21-8-13)14-3-4-14/h7-8,11,14-15H,3-6,9-10H2,1-2H3,(H,19,25)/t11-,15-/m1/s1
InChIKeyKPZQJCZVONCJPY-IAQYHMDHSA-N
MW372.43 g/mol
LogP1.76
Rot. Bonds5

About (2R,6R)-N-[2-(2-cyclopropylpyrimidin-5-yl)ethyl]-2-methyl-6-(3-methyl-1,2,4-oxadiazol-5-yl)morpholine-4-carboxamide

(2R,6R)-N-[2-(2-cyclopropylpyrimidin-5-yl)ethyl]-2-methyl-6-(3-methyl-1,2,4-oxadiazol-5-yl)morpholine-4-carboxamide (PubChem CID 126825314) has the molecular formula C18H24N6O3 and a molecular weight of 372.43 g/mol. Its IUPAC name is (2R,6R)-N-[2-(2-cyclopropylpyrimidin-5-yl)ethyl]-2-methyl-6-(3-methyl-1,2,4-oxadiazol-5-yl)morpholine-4-carboxamide.

Molecular Properties

Compound Name(2R,6R)-N-[2-(2-cyclopropylpyrimidin-5-yl)ethyl]-2-methyl-6-(3-methyl-1,2,4-oxadiazol-5-yl)morpholine-4-carboxamide
PubChem CID126825314
Molecular FormulaC18H24N6O3
Molecular Weight372.43 g/mol
Exact Mass372.19
IUPAC Name(2R,6R)-N-[2-(2-cyclopropylpyrimidin-5-yl)ethyl]-2-methyl-6-(3-methyl-1,2,4-oxadiazol-5-yl)morpholine-4-carboxamide
SMILESCc1noc([C@H]2CN(C(=O)NCCc3cnc(C4CC4)nc3)C[C@@H](C)O2)n1
InChIInChI=1S/C18H24N6O3/c1-11-9-24(10-15(26-11)17-22-12(2)23-27-17)18(25)19-6-5-13-7-20-16(21-8-13)14-3-4-14/h7-8,11,14-15H,3-6,9-10H2,1-2H3,(H,19,25)/t11-,15-/m1/s1
InChIKeyKPZQJCZVONCJPY-IAQYHMDHSA-N
XLogP1.76
TPSA106.27 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.43
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

(2S,6S)-2-cyclopropyl-N-[2-(2-cyclopropylpyrimidin-5-yl)ethyl]-6-methylmorpholine-4-carboxamide
CID 124740629
(2R,6R)-2-methyl-6-(3-methyl-1,2,4-oxadiazol-5-yl)morpholine-4-carboxamide
CID 146082113
(3R)-3-(3-methyl-1,2,4-oxadiazol-5-yl)-N-[2-(2,4,6-trimethylphenyl)ethyl]piperidine-1-carboxamide
CID 94801111
(4aS,8aR)-N-[2-(2-cyclopropylpyrimidin-5-yl)ethyl]-4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinoline-2-carboxamide
CID 124879669
2-methyl-N-[2-(1-methylpyrazol-4-yl)ethyl]-6-thiophen-3-ylmorpholine-4-carboxamide
CID 71851940
(2S,6S)-N-(2-cyclopropylpyrimidin-5-yl)-2-methyl-6-thiophen-3-ylmorpholine-4-carboxamide
CID 97225798
N-[2-(2-cyclopropylpyrimidin-5-yl)ethyl]-5,8-difluoro-3,4-dihydro-1H-isoquinoline-2-carboxamide
CID 127665029
(2R,6R)-N-[2-[4-(dimethylamino)phenyl]ethyl]-2,6-dimethylmorpholine-4-carboxamide
CID 95280981
N-[2-(2-cyclopropylpyrimidin-5-yl)ethyl]-5-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide
CID 100641585
[(2R,6R)-2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-6-methylmorpholin-4-yl]-(4,5,6,7-tetrahydro-1H-indol-2-yl)methanone
CID 154761710
(3S)-3-(3-methyl-1,2,4-oxadiazol-5-yl)-N-propan-2-ylpiperidine-1-carboxamide
CID 94178848
N-[2-(4-methoxyphenyl)ethyl]-3-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)azetidine-1-carboxamide
CID 121098803

Frequently Asked Questions

What is the IUPAC name of (2R,6R)-N-[2-(2-cyclopropylpyrimidin-5-yl)ethyl]-2-methyl-6-(3-methyl-1,2,4-oxadiazol-5-yl)morpholine-4-carboxamide?
The IUPAC name of (2R,6R)-N-[2-(2-cyclopropylpyrimidin-5-yl)ethyl]-2-methyl-6-(3-methyl-1,2,4-oxadiazol-5-yl)morpholine-4-carboxamide (CID 126825314) is (2R,6R)-N-[2-(2-cyclopropylpyrimidin-5-yl)ethyl]-2-methyl-6-(3-methyl-1,2,4-oxadiazol-5-yl)morpholine-4-carboxamide.
What is the SMILES notation for (2R,6R)-N-[2-(2-cyclopropylpyrimidin-5-yl)ethyl]-2-methyl-6-(3-methyl-1,2,4-oxadiazol-5-yl)morpholine-4-carboxamide?
The canonical SMILES for (2R,6R)-N-[2-(2-cyclopropylpyrimidin-5-yl)ethyl]-2-methyl-6-(3-methyl-1,2,4-oxadiazol-5-yl)morpholine-4-carboxamide is Cc1noc([C@H]2CN(C(=O)NCCc3cnc(C4CC4)nc3)C[C@@H](C)O2)n1.
What is the InChIKey of (2R,6R)-N-[2-(2-cyclopropylpyrimidin-5-yl)ethyl]-2-methyl-6-(3-methyl-1,2,4-oxadiazol-5-yl)morpholine-4-carboxamide?
The InChIKey is KPZQJCZVONCJPY-IAQYHMDHSA-N. The full InChI is InChI=1S/C18H24N6O3/c1-11-9-24(10-15(26-11)17-22-12(2)23-27-17)18(25)19-6-5-13-7-20-16(21-8-13)14-3-4-14/h7-8,11,14-15H,3-6,9-10H2,1-2H3,(H,19,25)/t11-,15-/m1/s1.
What are the key properties of (2R,6R)-N-[2-(2-cyclopropylpyrimidin-5-yl)ethyl]-2-methyl-6-(3-methyl-1,2,4-oxadiazol-5-yl)morpholine-4-carboxamide?
(2R,6R)-N-[2-(2-cyclopropylpyrimidin-5-yl)ethyl]-2-methyl-6-(3-methyl-1,2,4-oxadiazol-5-yl)morpholine-4-carboxamide has a molecular weight of 372.43 g/mol, XLogP of 1.76, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,6R)-N-[2-(2-cyclopropylpyrimidin-5-yl)ethyl]-2-methyl-6-(3-methyl-1,2,4-oxadiazol-5-yl)morpholine-4-carboxamide is sourced from PubChem (CID 126825314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).