5-methyl-2-(4-methylphenyl)-N-propylmorpholine-4-carboxamide

C16H24N2O2 — CID 110369505

IUPAC5-methyl-2-(4-methylphenyl)-N-propylmorpholine-4-carboxamide
SMILESCCCNC(=O)N1CC(c2ccc(C)cc2)OCC1C
InChIInChI=1S/C16H24N2O2/c1-4-9-17-16(19)18-10-15(20-11-13(18)3)14-7-5-12(2)6-8-14/h5-8,13,15H,4,9-11H2,1-3H3,(H,17,19)
InChIKeyMPCZMRHXMIASFS-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.88
Rot. Bonds3

About 5-methyl-2-(4-methylphenyl)-N-propylmorpholine-4-carboxamide

5-methyl-2-(4-methylphenyl)-N-propylmorpholine-4-carboxamide (PubChem CID 110369505) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 5-methyl-2-(4-methylphenyl)-N-propylmorpholine-4-carboxamide.

Molecular Properties

Compound Name5-methyl-2-(4-methylphenyl)-N-propylmorpholine-4-carboxamide
PubChem CID110369505
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name5-methyl-2-(4-methylphenyl)-N-propylmorpholine-4-carboxamide
SMILESCCCNC(=O)N1CC(c2ccc(C)cc2)OCC1C
InChIInChI=1S/C16H24N2O2/c1-4-9-17-16(19)18-10-15(20-11-13(18)3)14-7-5-12(2)6-8-14/h5-8,13,15H,4,9-11H2,1-3H3,(H,17,19)
InChIKeyMPCZMRHXMIASFS-UHFFFAOYSA-N
XLogP2.88
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

cyclohexyl-[5-methyl-2-(4-methylphenyl)morpholin-4-yl]methanone
CID 110369447
(4-fluorophenyl)-[5-methyl-2-(4-methylphenyl)morpholin-4-yl]methanone
CID 110369460
[5-methyl-2-(4-methylphenyl)morpholin-4-yl]-(3-methylphenyl)methanone
CID 110369456
[5-methyl-2-(4-methylphenyl)morpholin-4-yl]-(1-methylsulfonylpiperidin-4-yl)methanone
CID 110369501
2-(4-chlorophenyl)-N-propylmorpholine-4-carboxamide
CID 47326521
5-methyl-2-(4-methylphenyl)-4-methylsulfonylmorpholine
CID 110369509
2-ethyl-1-[2-(4-methoxyphenyl)-5-methylmorpholin-4-yl]butan-1-one
CID 110369570
(2S,5S)-N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]-5-methyl-2-(2-methylphenyl)morpholine-4-carboxamide
CID 96566156
N-butyl-2-methylaziridine-1-carboxamide
CID 91621648
2-methyl-3-(methylamino)-1-(5-methyl-2-phenylmorpholin-4-yl)propan-1-one
CID 119769860
2-(3,4-dichlorophenyl)-N-propylmorpholine-4-carboxamide
CID 110364326
4-[[[2-(2-chlorophenyl)-5-methylmorpholine-4-carbonyl]amino]methyl]benzoic acid
CID 122021175

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-(4-methylphenyl)-N-propylmorpholine-4-carboxamide?
The IUPAC name of 5-methyl-2-(4-methylphenyl)-N-propylmorpholine-4-carboxamide (CID 110369505) is 5-methyl-2-(4-methylphenyl)-N-propylmorpholine-4-carboxamide.
What is the SMILES notation for 5-methyl-2-(4-methylphenyl)-N-propylmorpholine-4-carboxamide?
The canonical SMILES for 5-methyl-2-(4-methylphenyl)-N-propylmorpholine-4-carboxamide is CCCNC(=O)N1CC(c2ccc(C)cc2)OCC1C.
What is the InChIKey of 5-methyl-2-(4-methylphenyl)-N-propylmorpholine-4-carboxamide?
The InChIKey is MPCZMRHXMIASFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-4-9-17-16(19)18-10-15(20-11-13(18)3)14-7-5-12(2)6-8-14/h5-8,13,15H,4,9-11H2,1-3H3,(H,17,19).
What are the key properties of 5-methyl-2-(4-methylphenyl)-N-propylmorpholine-4-carboxamide?
5-methyl-2-(4-methylphenyl)-N-propylmorpholine-4-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 2.88, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-(4-methylphenyl)-N-propylmorpholine-4-carboxamide is sourced from PubChem (CID 110369505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).