4-(2,4,5-trimethylphenyl)morpholine

C13H19NO — CID 20704896

IUPAC4-(2,4,5-trimethylphenyl)morpholine
SMILESCc1cc(C)c(N2CCOCC2)cc1C
InChIInChI=1S/C13H19NO/c1-10-8-12(3)13(9-11(10)2)14-4-6-15-7-5-14/h8-9H,4-7H2,1-3H3
InChIKeyKLZMQLWOAQYDAO-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.45
Rot. Bonds1

About 4-(2,4,5-trimethylphenyl)morpholine

4-(2,4,5-trimethylphenyl)morpholine (PubChem CID 20704896) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 4-(2,4,5-trimethylphenyl)morpholine.

Molecular Properties

Compound Name4-(2,4,5-trimethylphenyl)morpholine
PubChem CID20704896
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name4-(2,4,5-trimethylphenyl)morpholine
SMILESCc1cc(C)c(N2CCOCC2)cc1C
InChIInChI=1S/C13H19NO/c1-10-8-12(3)13(9-11(10)2)14-4-6-15-7-5-14/h8-9H,4-7H2,1-3H3
InChIKeyKLZMQLWOAQYDAO-UHFFFAOYSA-N
XLogP2.45
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-(p-Tolyl)morpholine
CID 766255
1(2H)-Quinolineethanol, 3,4-dihydro-2,2,4,7-tetramethyl-
CID 103845
4-(2-Benzyl-1,3,4,5-tetrahydro-2-benzazepin-7-yl)morpholine
CID 132075203
N,N-dimethyl-4-(2-morpholin-4-ylethyl)aniline
CID 3830898
N-(2,4-dimethyl-5-(morpholinomethyl)phenyl)-2,2-dimethylbutanamide
CID 45484720
4-[4-(1-Propylpiperidin-4-yl)phenyl]morpholine
CID 57387304
Asp-2205
CID 53379646
4-(4-{2-Nitrovinyl}-3-methylphenyl)morpholine
CID 1782673
Morpholine, 4-[1,1'-biphenyl]-4-yl-
CID 10911629
2,6-Diisopropyl-4-morpholinomethylaniline
CID 13609084
4-(Naphthalen-2-yl)morpholine
CID 344522
N-methyl-4-(morpholin-4-ylmethyl)-2,6-di(propan-2-yl)aniline
CID 44383792

Frequently Asked Questions

What is the IUPAC name of 4-(2,4,5-trimethylphenyl)morpholine?
The IUPAC name of 4-(2,4,5-trimethylphenyl)morpholine (CID 20704896) is 4-(2,4,5-trimethylphenyl)morpholine.
What is the SMILES notation for 4-(2,4,5-trimethylphenyl)morpholine?
The canonical SMILES for 4-(2,4,5-trimethylphenyl)morpholine is Cc1cc(C)c(N2CCOCC2)cc1C.
What is the InChIKey of 4-(2,4,5-trimethylphenyl)morpholine?
The InChIKey is KLZMQLWOAQYDAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-10-8-12(3)13(9-11(10)2)14-4-6-15-7-5-14/h8-9H,4-7H2,1-3H3.
What are the key properties of 4-(2,4,5-trimethylphenyl)morpholine?
4-(2,4,5-trimethylphenyl)morpholine has a molecular weight of 205.30 g/mol, XLogP of 2.45, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,4,5-trimethylphenyl)morpholine is sourced from PubChem (CID 20704896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).