[5-[(2,2,6-trimethylmorpholin-4-yl)methyl]furan-3-yl]methanamine

C13H22N2O2 — CID 62434742

IUPAC[5-[(2,2,6-trimethylmorpholin-4-yl)methyl]furan-3-yl]methanamine
SMILESCC1CN(Cc2cc(CN)co2)CC(C)(C)O1
InChIInChI=1S/C13H22N2O2/c1-10-6-15(9-13(2,3)17-10)7-12-4-11(5-14)8-16-12/h4,8,10H,5-7,9,14H2,1-3H3
InChIKeyOPSHPMYXYFVHDZ-UHFFFAOYSA-N
MW238.33 g/mol
LogP1.74
Rot. Bonds3

About [5-[(2,2,6-trimethylmorpholin-4-yl)methyl]furan-3-yl]methanamine

[5-[(2,2,6-trimethylmorpholin-4-yl)methyl]furan-3-yl]methanamine (PubChem CID 62434742) has the molecular formula C13H22N2O2 and a molecular weight of 238.33 g/mol. Its IUPAC name is [5-[(2,2,6-trimethylmorpholin-4-yl)methyl]furan-3-yl]methanamine.

Molecular Properties

Compound Name[5-[(2,2,6-trimethylmorpholin-4-yl)methyl]furan-3-yl]methanamine
PubChem CID62434742
Molecular FormulaC13H22N2O2
Molecular Weight238.33 g/mol
Exact Mass238.17
IUPAC Name[5-[(2,2,6-trimethylmorpholin-4-yl)methyl]furan-3-yl]methanamine
SMILESCC1CN(Cc2cc(CN)co2)CC(C)(C)O1
InChIInChI=1S/C13H22N2O2/c1-10-6-15(9-13(2,3)17-10)7-12-4-11(5-14)8-16-12/h4,8,10H,5-7,9,14H2,1-3H3
InChIKeyOPSHPMYXYFVHDZ-UHFFFAOYSA-N
XLogP1.74
TPSA51.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[3-chloro-4-[(2,2,6-trimethylmorpholin-4-yl)methyl]phenyl]methanamine
CID 102662894
N-methyl-1-[3-[(2,2,6-trimethylmorpholin-4-yl)methyl]phenyl]methanamine
CID 62436863
trimethyl-[4-[(2,2,6-trimethylmorpholin-4-yl)methyl]phenyl]silane
CID 103438391
6-[(2,2,6-trimethylmorpholin-4-yl)methyl]pyridin-2-amine
CID 79243466
N-[[5-[(2,2,6-trimethylmorpholin-4-yl)methyl]furan-2-yl]methyl]ethanamine
CID 62435098
2,6-dimethoxy-4-[(2,2,6-trimethylmorpholin-4-yl)methyl]phenol
CID 78976743
[2-[(2,2,6-trimethylmorpholin-4-yl)methyl]-1-benzofuran-3-yl]methanamine
CID 62434570
3-[(2,2,6-trimethylmorpholin-4-yl)methyl]benzonitrile
CID 47430318
4-bromo-2-methyl-6-[(2,2,6-trimethylmorpholin-4-yl)methyl]phenol
CID 112553577
N-[[4-[(2,2,6-trimethylmorpholin-4-yl)methyl]phenyl]methyl]ethanamine
CID 62435983
5-methyl-4-[(2,2,6-trimethylmorpholin-4-yl)methyl]furan-2-carbohydrazide
CID 63583647
N-[[5-[(2,2,6,6-tetramethylmorpholin-4-yl)methyl]furan-3-yl]methyl]cyclopropanamine
CID 102746010

Frequently Asked Questions

What is the IUPAC name of [5-[(2,2,6-trimethylmorpholin-4-yl)methyl]furan-3-yl]methanamine?
The IUPAC name of [5-[(2,2,6-trimethylmorpholin-4-yl)methyl]furan-3-yl]methanamine (CID 62434742) is [5-[(2,2,6-trimethylmorpholin-4-yl)methyl]furan-3-yl]methanamine.
What is the SMILES notation for [5-[(2,2,6-trimethylmorpholin-4-yl)methyl]furan-3-yl]methanamine?
The canonical SMILES for [5-[(2,2,6-trimethylmorpholin-4-yl)methyl]furan-3-yl]methanamine is CC1CN(Cc2cc(CN)co2)CC(C)(C)O1.
What is the InChIKey of [5-[(2,2,6-trimethylmorpholin-4-yl)methyl]furan-3-yl]methanamine?
The InChIKey is OPSHPMYXYFVHDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O2/c1-10-6-15(9-13(2,3)17-10)7-12-4-11(5-14)8-16-12/h4,8,10H,5-7,9,14H2,1-3H3.
What are the key properties of [5-[(2,2,6-trimethylmorpholin-4-yl)methyl]furan-3-yl]methanamine?
[5-[(2,2,6-trimethylmorpholin-4-yl)methyl]furan-3-yl]methanamine has a molecular weight of 238.33 g/mol, XLogP of 1.74, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[(2,2,6-trimethylmorpholin-4-yl)methyl]furan-3-yl]methanamine is sourced from PubChem (CID 62434742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).