N-[[2-[(2R)-4-(3,5-dimethyl-1,2-oxazole-4-carbonyl)morpholin-2-yl]pyrimidin-4-yl]methyl]acetamide

C17H21N5O4 — CID 124981285

IUPACN-[[2-[(2R)-4-(3,5-dimethyl-1,2-oxazole-4-carbonyl)morpholin-2-yl]pyrimidin-4-yl]methyl]acetamide
SMILESCC(=O)NCc1ccnc([C@H]2CN(C(=O)c3c(C)noc3C)CCO2)n1
InChIInChI=1S/C17H21N5O4/c1-10-15(11(2)26-21-10)17(24)22-6-7-25-14(9-22)16-18-5-4-13(20-16)8-19-12(3)23/h4-5,14H,6-9H2,1-3H3,(H,19,23)/t14-/m1/s1
InChIKeyMPAWKJLJOPDWTJ-CQSZACIVSA-N
MW359.39 g/mol
LogP0.93
Rot. Bonds4

About N-[[2-[(2R)-4-(3,5-dimethyl-1,2-oxazole-4-carbonyl)morpholin-2-yl]pyrimidin-4-yl]methyl]acetamide

N-[[2-[(2R)-4-(3,5-dimethyl-1,2-oxazole-4-carbonyl)morpholin-2-yl]pyrimidin-4-yl]methyl]acetamide (PubChem CID 124981285) has the molecular formula C17H21N5O4 and a molecular weight of 359.39 g/mol. Its IUPAC name is N-[[2-[(2R)-4-(3,5-dimethyl-1,2-oxazole-4-carbonyl)morpholin-2-yl]pyrimidin-4-yl]methyl]acetamide.

Molecular Properties

Compound NameN-[[2-[(2R)-4-(3,5-dimethyl-1,2-oxazole-4-carbonyl)morpholin-2-yl]pyrimidin-4-yl]methyl]acetamide
PubChem CID124981285
Molecular FormulaC17H21N5O4
Molecular Weight359.39 g/mol
Exact Mass359.16
IUPAC NameN-[[2-[(2R)-4-(3,5-dimethyl-1,2-oxazole-4-carbonyl)morpholin-2-yl]pyrimidin-4-yl]methyl]acetamide
SMILESCC(=O)NCc1ccnc([C@H]2CN(C(=O)c3c(C)noc3C)CCO2)n1
InChIInChI=1S/C17H21N5O4/c1-10-15(11(2)26-21-10)17(24)22-6-7-25-14(9-22)16-18-5-4-13(20-16)8-19-12(3)23/h4-5,14H,6-9H2,1-3H3,(H,19,23)/t14-/m1/s1
InChIKeyMPAWKJLJOPDWTJ-CQSZACIVSA-N
XLogP0.93
TPSA110.45 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.39
LogP ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-[[2-[(2R)-4-(3,5-dimethyl-1,2-oxazole-4-carbonyl)morpholin-2-yl]pyrimidin-4-yl]methyl]acetamide with MolForge

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Related Compounds

N-[[2-[(2R)-4-(4-methyl-1,3-oxazole-5-carbonyl)morpholin-2-yl]pyrimidin-4-yl]methyl]acetamide
CID 125015526
N-[[2-[(2S)-4-[(2-methylphenyl)methyl]morpholin-2-yl]pyrimidin-4-yl]methyl]acetamide
CID 124950073
N-[[2-[(2S)-4-[(3-methylphenyl)methyl]morpholin-2-yl]pyrimidin-4-yl]methyl]acetamide
CID 124954482
N-[[2-[(2S)-4-acetylmorpholin-2-yl]pyrimidin-4-yl]methyl]-3-ethyl-1,2-oxazole-5-carboxamide
CID 124969220
N-[[2-[(2R)-4-propan-2-ylsulfonylmorpholin-2-yl]pyrimidin-4-yl]methyl]acetamide
CID 125019910
[2-(3-aminopyrazin-2-yl)morpholin-4-yl]-(3,5-dimethyl-1,2-oxazol-4-yl)methanone
CID 110112797
2-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[(2R)-2-(4-methylpyrimidin-2-yl)morpholin-4-yl]ethanone
CID 125000690
N-[[2-[(2R)-4-(1H-imidazol-5-ylmethyl)morpholin-2-yl]pyrimidin-4-yl]methyl]acetamide
CID 125026880
(5-methyl-3-phenyl-1,2-oxazol-4-yl)-(2-phenylmorpholin-4-yl)methanone
CID 47021336
[2-(6-amino-2-pyridinyl)morpholin-4-yl]-(5-methyl-3-propan-2-yl-1,2-oxazol-4-yl)methanone
CID 110112377
[(2R)-2-(3-aminopyrazin-2-yl)morpholin-4-yl]-(5-methyl-3-propan-2-yl-1,2-oxazol-4-yl)methanone
CID 125011005
N-[[2-[(2S)-4-methylmorpholin-2-yl]pyrimidin-4-yl]methyl]-2-thiophen-2-ylacetamide
CID 124980906

Frequently Asked Questions

What is the IUPAC name of N-[[2-[(2R)-4-(3,5-dimethyl-1,2-oxazole-4-carbonyl)morpholin-2-yl]pyrimidin-4-yl]methyl]acetamide?
The IUPAC name of N-[[2-[(2R)-4-(3,5-dimethyl-1,2-oxazole-4-carbonyl)morpholin-2-yl]pyrimidin-4-yl]methyl]acetamide (CID 124981285) is N-[[2-[(2R)-4-(3,5-dimethyl-1,2-oxazole-4-carbonyl)morpholin-2-yl]pyrimidin-4-yl]methyl]acetamide.
What is the SMILES notation for N-[[2-[(2R)-4-(3,5-dimethyl-1,2-oxazole-4-carbonyl)morpholin-2-yl]pyrimidin-4-yl]methyl]acetamide?
The canonical SMILES for N-[[2-[(2R)-4-(3,5-dimethyl-1,2-oxazole-4-carbonyl)morpholin-2-yl]pyrimidin-4-yl]methyl]acetamide is CC(=O)NCc1ccnc([C@H]2CN(C(=O)c3c(C)noc3C)CCO2)n1.
What is the InChIKey of N-[[2-[(2R)-4-(3,5-dimethyl-1,2-oxazole-4-carbonyl)morpholin-2-yl]pyrimidin-4-yl]methyl]acetamide?
The InChIKey is MPAWKJLJOPDWTJ-CQSZACIVSA-N. The full InChI is InChI=1S/C17H21N5O4/c1-10-15(11(2)26-21-10)17(24)22-6-7-25-14(9-22)16-18-5-4-13(20-16)8-19-12(3)23/h4-5,14H,6-9H2,1-3H3,(H,19,23)/t14-/m1/s1.
What are the key properties of N-[[2-[(2R)-4-(3,5-dimethyl-1,2-oxazole-4-carbonyl)morpholin-2-yl]pyrimidin-4-yl]methyl]acetamide?
N-[[2-[(2R)-4-(3,5-dimethyl-1,2-oxazole-4-carbonyl)morpholin-2-yl]pyrimidin-4-yl]methyl]acetamide has a molecular weight of 359.39 g/mol, XLogP of 0.93, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-[(2R)-4-(3,5-dimethyl-1,2-oxazole-4-carbonyl)morpholin-2-yl]pyrimidin-4-yl]methyl]acetamide is sourced from PubChem (CID 124981285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).