2-(2-methoxy-5-methylphenyl)-N-[(2R)-1-morpholin-4-ylbutan-2-yl]acetamide

C18H28N2O3 — CID 51872361

IUPAC2-(2-methoxy-5-methylphenyl)-N-[(2R)-1-morpholin-4-ylbutan-2-yl]acetamide
SMILESCC[C@H](CN1CCOCC1)NC(=O)Cc1cc(C)ccc1OC
InChIInChI=1S/C18H28N2O3/c1-4-16(13-20-7-9-23-10-8-20)19-18(21)12-15-11-14(2)5-6-17(15)22-3/h5-6,11,16H,4,7-10,12-13H2,1-3H3,(H,19,21)/t16-/m1/s1
InChIKeyGXVUPCUUSAAFLZ-MRXNPFEDSA-N
MW320.43 g/mol
LogP1.77
Rot. Bonds7

About 2-(2-methoxy-5-methylphenyl)-N-[(2R)-1-morpholin-4-ylbutan-2-yl]acetamide

2-(2-methoxy-5-methylphenyl)-N-[(2R)-1-morpholin-4-ylbutan-2-yl]acetamide (PubChem CID 51872361) has the molecular formula C18H28N2O3 and a molecular weight of 320.43 g/mol. Its IUPAC name is 2-(2-methoxy-5-methylphenyl)-N-[(2R)-1-morpholin-4-ylbutan-2-yl]acetamide.

Molecular Properties

Compound Name2-(2-methoxy-5-methylphenyl)-N-[(2R)-1-morpholin-4-ylbutan-2-yl]acetamide
PubChem CID51872361
Molecular FormulaC18H28N2O3
Molecular Weight320.43 g/mol
Exact Mass320.21
IUPAC Name2-(2-methoxy-5-methylphenyl)-N-[(2R)-1-morpholin-4-ylbutan-2-yl]acetamide
SMILESCC[C@H](CN1CCOCC1)NC(=O)Cc1cc(C)ccc1OC
InChIInChI=1S/C18H28N2O3/c1-4-16(13-20-7-9-23-10-8-20)19-18(21)12-15-11-14(2)5-6-17(15)22-3/h5-6,11,16H,4,7-10,12-13H2,1-3H3,(H,19,21)/t16-/m1/s1
InChIKeyGXVUPCUUSAAFLZ-MRXNPFEDSA-N
XLogP1.77
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.43
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-methoxy-5-methylphenyl)-N-[(2R)-1-(4-methylpiperazin-1-yl)butan-2-yl]acetamide
CID 51589916
2-(5-acetyl-2-methoxyphenyl)-N-[(2S)-1-pyrrolidin-1-ylbutan-2-yl]acetamide
CID 51505135
2-(2,5-dimethyl-1H-indol-3-yl)-N-(1-morpholin-4-ylbutan-2-yl)acetamide
CID 16673953
2-[[2-(2-methoxy-5-methylphenyl)acetyl]amino]butanoic acid
CID 43388197
2-(6-methyl-1-benzofuran-3-yl)-N-[(2S)-1-pyrrolidin-1-ylbutan-2-yl]acetamide
CID 51505096
2-(6-methyl-1-benzofuran-3-yl)-N-[1-(4-methylpiperazin-1-yl)butan-2-yl]acetamide
CID 46966909
2-(5-fluoro-2-methyl-1H-indol-3-yl)-N-[(2S)-1-morpholin-4-ylbutan-2-yl]acetamide
CID 51593800
(2S)-3-(2-methoxy-5-methylphenyl)-2-morpholin-4-ylpropanoic acid
CID 100553628
2-(2-methoxy-5-methylphenyl)-N-[(2R)-1-methoxypropan-2-yl]acetamide
CID 39969472
2-(2-methoxy-5-methylphenyl)-N-methylacetamide
CID 39969431
2-(5-chloro-2-methoxyphenyl)-N-[(2R)-1-hydroxybutan-2-yl]acetamide
CID 113351921
(E)-3-(2-methoxy-5-methylphenyl)-N-[1-(4-methylphenyl)-2-morpholin-4-ylethyl]prop-2-enamide
CID 24505100

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxy-5-methylphenyl)-N-[(2R)-1-morpholin-4-ylbutan-2-yl]acetamide?
The IUPAC name of 2-(2-methoxy-5-methylphenyl)-N-[(2R)-1-morpholin-4-ylbutan-2-yl]acetamide (CID 51872361) is 2-(2-methoxy-5-methylphenyl)-N-[(2R)-1-morpholin-4-ylbutan-2-yl]acetamide.
What is the SMILES notation for 2-(2-methoxy-5-methylphenyl)-N-[(2R)-1-morpholin-4-ylbutan-2-yl]acetamide?
The canonical SMILES for 2-(2-methoxy-5-methylphenyl)-N-[(2R)-1-morpholin-4-ylbutan-2-yl]acetamide is CC[C@H](CN1CCOCC1)NC(=O)Cc1cc(C)ccc1OC.
What is the InChIKey of 2-(2-methoxy-5-methylphenyl)-N-[(2R)-1-morpholin-4-ylbutan-2-yl]acetamide?
The InChIKey is GXVUPCUUSAAFLZ-MRXNPFEDSA-N. The full InChI is InChI=1S/C18H28N2O3/c1-4-16(13-20-7-9-23-10-8-20)19-18(21)12-15-11-14(2)5-6-17(15)22-3/h5-6,11,16H,4,7-10,12-13H2,1-3H3,(H,19,21)/t16-/m1/s1.
What are the key properties of 2-(2-methoxy-5-methylphenyl)-N-[(2R)-1-morpholin-4-ylbutan-2-yl]acetamide?
2-(2-methoxy-5-methylphenyl)-N-[(2R)-1-morpholin-4-ylbutan-2-yl]acetamide has a molecular weight of 320.43 g/mol, XLogP of 1.77, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxy-5-methylphenyl)-N-[(2R)-1-morpholin-4-ylbutan-2-yl]acetamide is sourced from PubChem (CID 51872361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).