N-(3,4-dimethylphenyl)-2,6-dimethylmorpholine-4-carboxamide

C15H22N2O2 — CID 4570981

IUPACN-(3,4-dimethylphenyl)-2,6-dimethylmorpholine-4-carboxamide
SMILESCc1ccc(NC(=O)N2CC(C)OC(C)C2)cc1C
InChIInChI=1S/C15H22N2O2/c1-10-5-6-14(7-11(10)2)16-15(18)17-8-12(3)19-13(4)9-17/h5-7,12-13H,8-9H2,1-4H3,(H,16,18)
InChIKeyZHCLVNMGQNCONS-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.94
Rot. Bonds1

About N-(3,4-dimethylphenyl)-2,6-dimethylmorpholine-4-carboxamide

N-(3,4-dimethylphenyl)-2,6-dimethylmorpholine-4-carboxamide (PubChem CID 4570981) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-(3,4-dimethylphenyl)-2,6-dimethylmorpholine-4-carboxamide.

Molecular Properties

Compound NameN-(3,4-dimethylphenyl)-2,6-dimethylmorpholine-4-carboxamide
PubChem CID4570981
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-(3,4-dimethylphenyl)-2,6-dimethylmorpholine-4-carboxamide
SMILESCc1ccc(NC(=O)N2CC(C)OC(C)C2)cc1C
InChIInChI=1S/C15H22N2O2/c1-10-5-6-14(7-11(10)2)16-15(18)17-8-12(3)19-13(4)9-17/h5-7,12-13H,8-9H2,1-4H3,(H,16,18)
InChIKeyZHCLVNMGQNCONS-UHFFFAOYSA-N
XLogP2.94
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R,6R)-N-(4-bromo-3-methylphenyl)-2,6-dimethylmorpholine-4-carboxamide
CID 51944457
(2R,6S)-N-[4-[[(2R,6S)-2,6-dimethylmorpholine-4-carbonyl]amino]phenyl]-2,6-dimethylmorpholine-4-carboxamide
CID 51983955
(2R,6S)-2,6-dimethyl-N-(3-methyl-4-nitrophenyl)morpholine-4-carboxamide
CID 75509755
(2S,6S)-N-(3,4-dichlorophenyl)-2,6-dimethylmorpholine-4-carboxamide
CID 726111
2-(2,6-dimethylmorpholin-4-yl)-N-(3,4-dimethylphenyl)acetamide
CID 6465799
2-(3,4-dimethylanilino)-1-(2,6-dimethylmorpholin-4-yl)propan-1-one
CID 17399590
(2S,6R)-2,6-dimethyl-N-phenylmorpholine-4-carboxamide
CID 42545481
(2S,6S)-2,6-dimethyl-N-phenylmorpholine-4-carboxamide
CID 41097584
5-[[(2R,6S)-2,6-dimethylmorpholine-4-carbonyl]amino]-2-hydroxybenzoic acid
CID 104959655
2-[1-[(3,4-dimethylphenyl)carbamoyl]azetidin-3-yl]propanoic acid
CID 116682807
(2R,6R)-N-(3-chlorophenyl)-2,6-dimethylmorpholine-4-carboxamide
CID 41097571
(2S,6S)-N-(3-acetylphenyl)-2,6-dimethylmorpholine-4-carboxamide
CID 969916

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethylphenyl)-2,6-dimethylmorpholine-4-carboxamide?
The IUPAC name of N-(3,4-dimethylphenyl)-2,6-dimethylmorpholine-4-carboxamide (CID 4570981) is N-(3,4-dimethylphenyl)-2,6-dimethylmorpholine-4-carboxamide.
What is the SMILES notation for N-(3,4-dimethylphenyl)-2,6-dimethylmorpholine-4-carboxamide?
The canonical SMILES for N-(3,4-dimethylphenyl)-2,6-dimethylmorpholine-4-carboxamide is Cc1ccc(NC(=O)N2CC(C)OC(C)C2)cc1C.
What is the InChIKey of N-(3,4-dimethylphenyl)-2,6-dimethylmorpholine-4-carboxamide?
The InChIKey is ZHCLVNMGQNCONS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-10-5-6-14(7-11(10)2)16-15(18)17-8-12(3)19-13(4)9-17/h5-7,12-13H,8-9H2,1-4H3,(H,16,18).
What are the key properties of N-(3,4-dimethylphenyl)-2,6-dimethylmorpholine-4-carboxamide?
N-(3,4-dimethylphenyl)-2,6-dimethylmorpholine-4-carboxamide has a molecular weight of 262.35 g/mol, XLogP of 2.94, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethylphenyl)-2,6-dimethylmorpholine-4-carboxamide is sourced from PubChem (CID 4570981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).