5-methyl-2-(2-phenylethyl)-N-propan-2-ylmorpholine-4-carboxamide

C17H26N2O2 — CID 110746747

IUPAC5-methyl-2-(2-phenylethyl)-N-propan-2-ylmorpholine-4-carboxamide
SMILESCC(C)NC(=O)N1CC(CCc2ccccc2)OCC1C
InChIInChI=1S/C17H26N2O2/c1-13(2)18-17(20)19-11-16(21-12-14(19)3)10-9-15-7-5-4-6-8-15/h4-8,13-14,16H,9-12H2,1-3H3,(H,18,20)
InChIKeyJLWQZVYPWVGVGX-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.83
Rot. Bonds4

About 5-methyl-2-(2-phenylethyl)-N-propan-2-ylmorpholine-4-carboxamide

5-methyl-2-(2-phenylethyl)-N-propan-2-ylmorpholine-4-carboxamide (PubChem CID 110746747) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 5-methyl-2-(2-phenylethyl)-N-propan-2-ylmorpholine-4-carboxamide.

Molecular Properties

Compound Name5-methyl-2-(2-phenylethyl)-N-propan-2-ylmorpholine-4-carboxamide
PubChem CID110746747
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name5-methyl-2-(2-phenylethyl)-N-propan-2-ylmorpholine-4-carboxamide
SMILESCC(C)NC(=O)N1CC(CCc2ccccc2)OCC1C
InChIInChI=1S/C17H26N2O2/c1-13(2)18-17(20)19-11-16(21-12-14(19)3)10-9-15-7-5-4-6-8-15/h4-8,13-14,16H,9-12H2,1-3H3,(H,18,20)
InChIKeyJLWQZVYPWVGVGX-UHFFFAOYSA-N
XLogP2.83
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[5-methyl-2-(2-phenylethyl)morpholin-4-yl]ethanone
CID 110706995
2-(aminomethyl)-5-methyl-N-phenylmorpholine-4-carboxamide
CID 81217697
1-(2-benzyl-5-methylmorpholin-4-yl)propan-1-one
CID 110643992
(2-benzyl-5-methylmorpholin-4-yl)-cyclopentylmethanone
CID 110643999
(2R)-2-[[2-(hydroxymethyl)-5-methylmorpholine-4-carbonyl]amino]-3-methylbutanoic acid
CID 81205269
2-[[2-(hydroxymethyl)-5-methylmorpholine-4-carbonyl]amino]-2-thiophen-2-ylacetic acid
CID 115285671
(2-benzyl-5-methylmorpholin-4-yl)-(2-methylphenyl)methanone
CID 110644004
1-(2-benzyl-5-methylmorpholin-4-yl)pentan-1-one
CID 110643995
N-(2-chlorophenyl)-2-(hydroxymethyl)-5-methylmorpholine-4-carboxamide
CID 81218679
N,N-dimethyl-2-(2-phenylethyl)morpholine-4-carboxamide
CID 75521628
[5-chloro-2-[2-[(2R,5R)-2-[2-(4-fluorophenyl)ethyl]-5-methylmorpholin-4-yl]-2-oxoethoxy]phenyl]urea
CID 59393976
N-[2-(2-phenylethyl)oxan-4-yl]acetamide
CID 102519747

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-(2-phenylethyl)-N-propan-2-ylmorpholine-4-carboxamide?
The IUPAC name of 5-methyl-2-(2-phenylethyl)-N-propan-2-ylmorpholine-4-carboxamide (CID 110746747) is 5-methyl-2-(2-phenylethyl)-N-propan-2-ylmorpholine-4-carboxamide.
What is the SMILES notation for 5-methyl-2-(2-phenylethyl)-N-propan-2-ylmorpholine-4-carboxamide?
The canonical SMILES for 5-methyl-2-(2-phenylethyl)-N-propan-2-ylmorpholine-4-carboxamide is CC(C)NC(=O)N1CC(CCc2ccccc2)OCC1C.
What is the InChIKey of 5-methyl-2-(2-phenylethyl)-N-propan-2-ylmorpholine-4-carboxamide?
The InChIKey is JLWQZVYPWVGVGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-13(2)18-17(20)19-11-16(21-12-14(19)3)10-9-15-7-5-4-6-8-15/h4-8,13-14,16H,9-12H2,1-3H3,(H,18,20).
What are the key properties of 5-methyl-2-(2-phenylethyl)-N-propan-2-ylmorpholine-4-carboxamide?
5-methyl-2-(2-phenylethyl)-N-propan-2-ylmorpholine-4-carboxamide has a molecular weight of 290.41 g/mol, XLogP of 2.83, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-(2-phenylethyl)-N-propan-2-ylmorpholine-4-carboxamide is sourced from PubChem (CID 110746747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).