4-methoxy-2,3,6-trimethyl-N-(morpholin-3-ylmethyl)aniline

C15H24N2O2 — CID 115237900

IUPAC4-methoxy-2,3,6-trimethyl-N-(morpholin-3-ylmethyl)aniline
SMILESCOc1cc(C)c(NCC2COCCN2)c(C)c1C
InChIInChI=1S/C15H24N2O2/c1-10-7-14(18-4)11(2)12(3)15(10)17-8-13-9-19-6-5-16-13/h7,13,16-17H,5-6,8-9H2,1-4H3
InChIKeyFLNBSVABLOHPKV-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.02
Rot. Bonds4

About 4-methoxy-2,3,6-trimethyl-N-(morpholin-3-ylmethyl)aniline

4-methoxy-2,3,6-trimethyl-N-(morpholin-3-ylmethyl)aniline (PubChem CID 115237900) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 4-methoxy-2,3,6-trimethyl-N-(morpholin-3-ylmethyl)aniline.

Molecular Properties

Compound Name4-methoxy-2,3,6-trimethyl-N-(morpholin-3-ylmethyl)aniline
PubChem CID115237900
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name4-methoxy-2,3,6-trimethyl-N-(morpholin-3-ylmethyl)aniline
SMILESCOc1cc(C)c(NCC2COCCN2)c(C)c1C
InChIInChI=1S/C15H24N2O2/c1-10-7-14(18-4)11(2)12(3)15(10)17-8-13-9-19-6-5-16-13/h7,13,16-17H,5-6,8-9H2,1-4H3
InChIKeyFLNBSVABLOHPKV-UHFFFAOYSA-N
XLogP2.02
TPSA42.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.02
H-Bond Donors ≤ 52
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

2,4-dimethoxy-6-methyl-N-(morpholin-3-ylmethyl)aniline
CID 115237892
N-[(4-methoxy-3,5-dimethylphenyl)methyl]-1-morpholin-3-ylmethanamine
CID 115238057
3-ethyl-4-methoxy-N-(morpholin-3-ylmethyl)aniline
CID 115237844
2-methoxy-N-[[(3S)-morpholin-3-yl]methyl]aniline
CID 99962582
2,5-difluoro-4-methoxy-N-(morpholin-3-ylmethyl)aniline
CID 115237891
3-[2-(4-methoxy-3-methylphenyl)ethyl]morpholine
CID 116928186
N-[(2-methoxy-3,5-dimethylphenyl)methyl]-1-morpholin-3-ylmethanamine
CID 115238028
7-methyl-N-(morpholin-3-ylmethyl)-2,3-dihydro-1,4-benzodioxin-6-amine
CID 115237864
2-methoxy-N-(morpholin-3-ylmethyl)pyridin-4-amine
CID 103549304
3-[(5-chloro-2-methoxy-4-methylphenyl)methyl]morpholine
CID 116927929
1-(2-methoxy-4,5-dimethylphenyl)-2-morpholin-3-ylethanone
CID 116919891
3-[2-(2-methoxy-4,6-dimethylphenyl)ethyl]morpholine
CID 116928232

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2,3,6-trimethyl-N-(morpholin-3-ylmethyl)aniline?
The IUPAC name of 4-methoxy-2,3,6-trimethyl-N-(morpholin-3-ylmethyl)aniline (CID 115237900) is 4-methoxy-2,3,6-trimethyl-N-(morpholin-3-ylmethyl)aniline.
What is the SMILES notation for 4-methoxy-2,3,6-trimethyl-N-(morpholin-3-ylmethyl)aniline?
The canonical SMILES for 4-methoxy-2,3,6-trimethyl-N-(morpholin-3-ylmethyl)aniline is COc1cc(C)c(NCC2COCCN2)c(C)c1C.
What is the InChIKey of 4-methoxy-2,3,6-trimethyl-N-(morpholin-3-ylmethyl)aniline?
The InChIKey is FLNBSVABLOHPKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-10-7-14(18-4)11(2)12(3)15(10)17-8-13-9-19-6-5-16-13/h7,13,16-17H,5-6,8-9H2,1-4H3.
What are the key properties of 4-methoxy-2,3,6-trimethyl-N-(morpholin-3-ylmethyl)aniline?
4-methoxy-2,3,6-trimethyl-N-(morpholin-3-ylmethyl)aniline has a molecular weight of 264.37 g/mol, XLogP of 2.02, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2,3,6-trimethyl-N-(morpholin-3-ylmethyl)aniline is sourced from PubChem (CID 115237900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).