N-[(4-ethylmorpholin-2-yl)methyl]-4-methoxy-3-methylaniline

C15H24N2O2 — CID 79166344

IUPACN-[(4-ethylmorpholin-2-yl)methyl]-4-methoxy-3-methylaniline
SMILESCCN1CCOC(CNc2ccc(OC)c(C)c2)C1
InChIInChI=1S/C15H24N2O2/c1-4-17-7-8-19-14(11-17)10-16-13-5-6-15(18-3)12(2)9-13/h5-6,9,14,16H,4,7-8,10-11H2,1-3H3
InChIKeySWRBYZFFZFNHBS-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.14
Rot. Bonds5

About N-[(4-ethylmorpholin-2-yl)methyl]-4-methoxy-3-methylaniline

N-[(4-ethylmorpholin-2-yl)methyl]-4-methoxy-3-methylaniline (PubChem CID 79166344) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is N-[(4-ethylmorpholin-2-yl)methyl]-4-methoxy-3-methylaniline.

Molecular Properties

Compound NameN-[(4-ethylmorpholin-2-yl)methyl]-4-methoxy-3-methylaniline
PubChem CID79166344
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC NameN-[(4-ethylmorpholin-2-yl)methyl]-4-methoxy-3-methylaniline
SMILESCCN1CCOC(CNc2ccc(OC)c(C)c2)C1
InChIInChI=1S/C15H24N2O2/c1-4-17-7-8-19-14(11-17)10-16-13-5-6-15(18-3)12(2)9-13/h5-6,9,14,16H,4,7-8,10-11H2,1-3H3
InChIKeySWRBYZFFZFNHBS-UHFFFAOYSA-N
XLogP2.14
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

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Related Compounds

4-bromo-N-[(4-ethylmorpholin-2-yl)methyl]-3-methylaniline
CID 79165325
4-chloro-N-[(4-ethylmorpholin-2-yl)methyl]-2,5-dimethoxyaniline
CID 79164835
N-[(4-ethylmorpholin-2-yl)methyl]-3-fluoroaniline
CID 79166710
N-[(4-ethylmorpholin-2-yl)methyl]-4-propylaniline
CID 79166530
N-[(4-ethylmorpholin-2-yl)methyl]pyridin-4-amine
CID 114400660
3-fluoro-4-methoxy-N-[(4-methylmorpholin-2-yl)methyl]aniline
CID 79172561
N-[(4-ethylmorpholin-2-yl)methyl]-3,4,5-trifluoroaniline
CID 79165761
2-chloro-4-[(4-ethylmorpholin-2-yl)methylamino]benzenecarbothioamide
CID 114400165
4-[(4-ethylmorpholin-2-yl)methylamino]benzamide
CID 79166709
4-[(4-ethylmorpholin-2-yl)methylamino]-N-methylbenzenesulfonamide
CID 114400653
N-[(4-ethylmorpholin-2-yl)methyl]-1-(3-fluoro-4-methoxyphenyl)ethanamine
CID 115899761
1-(3-bromo-4-methoxyphenyl)-N-[(4-ethylmorpholin-2-yl)methyl]ethanamine
CID 115899774

Frequently Asked Questions

What is the IUPAC name of N-[(4-ethylmorpholin-2-yl)methyl]-4-methoxy-3-methylaniline?
The IUPAC name of N-[(4-ethylmorpholin-2-yl)methyl]-4-methoxy-3-methylaniline (CID 79166344) is N-[(4-ethylmorpholin-2-yl)methyl]-4-methoxy-3-methylaniline.
What is the SMILES notation for N-[(4-ethylmorpholin-2-yl)methyl]-4-methoxy-3-methylaniline?
The canonical SMILES for N-[(4-ethylmorpholin-2-yl)methyl]-4-methoxy-3-methylaniline is CCN1CCOC(CNc2ccc(OC)c(C)c2)C1.
What is the InChIKey of N-[(4-ethylmorpholin-2-yl)methyl]-4-methoxy-3-methylaniline?
The InChIKey is SWRBYZFFZFNHBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-4-17-7-8-19-14(11-17)10-16-13-5-6-15(18-3)12(2)9-13/h5-6,9,14,16H,4,7-8,10-11H2,1-3H3.
What are the key properties of N-[(4-ethylmorpholin-2-yl)methyl]-4-methoxy-3-methylaniline?
N-[(4-ethylmorpholin-2-yl)methyl]-4-methoxy-3-methylaniline has a molecular weight of 264.37 g/mol, XLogP of 2.14, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-ethylmorpholin-2-yl)methyl]-4-methoxy-3-methylaniline is sourced from PubChem (CID 79166344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).