N,N-dimethyl-4-morpholin-4-ylaniline

C12H18N2O — CID 11264229

IUPACN,N-dimethyl-4-morpholin-4-ylaniline
SMILESCN(C)c1ccc(N2CCOCC2)cc1
InChIInChI=1S/C12H18N2O/c1-13(2)11-3-5-12(6-4-11)14-7-9-15-10-8-14/h3-6H,7-10H2,1-2H3
InChIKeySGJAGPMXKAQKEK-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.59
Rot. Bonds2

About N,N-dimethyl-4-morpholin-4-ylaniline

N,N-dimethyl-4-morpholin-4-ylaniline (PubChem CID 11264229) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is N,N-dimethyl-4-morpholin-4-ylaniline.

Molecular Properties

Compound NameN,N-dimethyl-4-morpholin-4-ylaniline
PubChem CID11264229
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC NameN,N-dimethyl-4-morpholin-4-ylaniline
SMILESCN(C)c1ccc(N2CCOCC2)cc1
InChIInChI=1S/C12H18N2O/c1-13(2)11-3-5-12(6-4-11)14-7-9-15-10-8-14/h3-6H,7-10H2,1-2H3
InChIKeySGJAGPMXKAQKEK-UHFFFAOYSA-N
XLogP1.59
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-morpholin-4-ylaniline?
The IUPAC name of N,N-dimethyl-4-morpholin-4-ylaniline (CID 11264229) is N,N-dimethyl-4-morpholin-4-ylaniline.
What is the SMILES notation for N,N-dimethyl-4-morpholin-4-ylaniline?
The canonical SMILES for N,N-dimethyl-4-morpholin-4-ylaniline is CN(C)c1ccc(N2CCOCC2)cc1.
What is the InChIKey of N,N-dimethyl-4-morpholin-4-ylaniline?
The InChIKey is SGJAGPMXKAQKEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c1-13(2)11-3-5-12(6-4-11)14-7-9-15-10-8-14/h3-6H,7-10H2,1-2H3.
What are the key properties of N,N-dimethyl-4-morpholin-4-ylaniline?
N,N-dimethyl-4-morpholin-4-ylaniline has a molecular weight of 206.29 g/mol, XLogP of 1.59, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-morpholin-4-ylaniline is sourced from PubChem (CID 11264229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).