N-[2-(2,5-dimethylmorpholin-4-yl)ethyl]-2-methylaniline

C15H24N2O — CID 62560224

IUPACN-[2-(2,5-dimethylmorpholin-4-yl)ethyl]-2-methylaniline
SMILESCc1ccccc1NCCN1CC(C)OCC1C
InChIInChI=1S/C15H24N2O/c1-12-6-4-5-7-15(12)16-8-9-17-10-14(3)18-11-13(17)2/h4-7,13-14,16H,8-11H2,1-3H3
InChIKeyCTLQIIBQUZCSMQ-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.52
Rot. Bonds4

About N-[2-(2,5-dimethylmorpholin-4-yl)ethyl]-2-methylaniline

N-[2-(2,5-dimethylmorpholin-4-yl)ethyl]-2-methylaniline (PubChem CID 62560224) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is N-[2-(2,5-dimethylmorpholin-4-yl)ethyl]-2-methylaniline.

Molecular Properties

Compound NameN-[2-(2,5-dimethylmorpholin-4-yl)ethyl]-2-methylaniline
PubChem CID62560224
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC NameN-[2-(2,5-dimethylmorpholin-4-yl)ethyl]-2-methylaniline
SMILESCc1ccccc1NCCN1CC(C)OCC1C
InChIInChI=1S/C15H24N2O/c1-12-6-4-5-7-15(12)16-8-9-17-10-14(3)18-11-13(17)2/h4-7,13-14,16H,8-11H2,1-3H3
InChIKeyCTLQIIBQUZCSMQ-UHFFFAOYSA-N
XLogP2.52
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2,5-dimethylmorpholin-4-yl)ethyl]-2-methylaniline?
The IUPAC name of N-[2-(2,5-dimethylmorpholin-4-yl)ethyl]-2-methylaniline (CID 62560224) is N-[2-(2,5-dimethylmorpholin-4-yl)ethyl]-2-methylaniline.
What is the SMILES notation for N-[2-(2,5-dimethylmorpholin-4-yl)ethyl]-2-methylaniline?
The canonical SMILES for N-[2-(2,5-dimethylmorpholin-4-yl)ethyl]-2-methylaniline is Cc1ccccc1NCCN1CC(C)OCC1C.
What is the InChIKey of N-[2-(2,5-dimethylmorpholin-4-yl)ethyl]-2-methylaniline?
The InChIKey is CTLQIIBQUZCSMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-12-6-4-5-7-15(12)16-8-9-17-10-14(3)18-11-13(17)2/h4-7,13-14,16H,8-11H2,1-3H3.
What are the key properties of N-[2-(2,5-dimethylmorpholin-4-yl)ethyl]-2-methylaniline?
N-[2-(2,5-dimethylmorpholin-4-yl)ethyl]-2-methylaniline has a molecular weight of 248.37 g/mol, XLogP of 2.52, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,5-dimethylmorpholin-4-yl)ethyl]-2-methylaniline is sourced from PubChem (CID 62560224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).