[6-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-3-pyridinyl]methanamine

C12H19N3O — CID 30047687

IUPAC[6-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-3-pyridinyl]methanamine
SMILESC[C@H]1CN(c2ccc(CN)cn2)C[C@H](C)O1
InChIInChI=1S/C12H19N3O/c1-9-7-15(8-10(2)16-9)12-4-3-11(5-13)6-14-12/h3-4,6,9-10H,5,7-8,13H2,1-2H3/t9-,10-/m0/s1
InChIKeyDKOOGSOFRGBDJP-UWVGGRQHSA-N
MW221.30 g/mol
LogP1.15
Rot. Bonds2

About [6-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-3-pyridinyl]methanamine

[6-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-3-pyridinyl]methanamine (PubChem CID 30047687) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is [6-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-3-pyridinyl]methanamine.

Molecular Properties

Compound Name[6-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-3-pyridinyl]methanamine
PubChem CID30047687
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name[6-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-3-pyridinyl]methanamine
SMILESC[C@H]1CN(c2ccc(CN)cn2)C[C@H](C)O1
InChIInChI=1S/C12H19N3O/c1-9-7-15(8-10(2)16-9)12-4-3-11(5-13)6-14-12/h3-4,6,9-10H,5,7-8,13H2,1-2H3/t9-,10-/m0/s1
InChIKeyDKOOGSOFRGBDJP-UWVGGRQHSA-N
XLogP1.15
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-3-pyridinyl]-N-methylmethanamine
CID 104959494
[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]pyrimidin-5-yl]methanamine
CID 104959418
(2R)-2,6-dimethyl-4-(5-methyl-2-pyridinyl)morpholine
CID 143577570
1-tert-butyl-2-[[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]methyl]guanidine
CID 119118388
[6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-5-methyl-3-pyridinyl]methanamine
CID 104959500
2-[[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]methyl]-1-propylguanidine;hydroiodide
CID 111049111
1-cyclohexyl-2-[[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]methyl]guanidine
CID 111049108
3-[[[6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-3-pyridinyl]methylamino]methyl]phenol
CID 95313017
(2R,6R)-2,6-dimethyl-4-[5-(7-propan-2-ylsulfonylheptyl)-2-pyridinyl]morpholine
CID 160858579
1-[5-(aminomethyl)-2-pyridinyl]-N,N-dimethylpyrrolidin-3-amine
CID 63166581
(2S,6R)-4-(5-butan-2-yl-2-pyridinyl)-2,6-dimethylmorpholine
CID 71155007
[5-chloro-2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-4-pyridinyl]methanamine
CID 104984134

Frequently Asked Questions

What is the IUPAC name of [6-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-3-pyridinyl]methanamine?
The IUPAC name of [6-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-3-pyridinyl]methanamine (CID 30047687) is [6-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-3-pyridinyl]methanamine.
What is the SMILES notation for [6-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-3-pyridinyl]methanamine?
The canonical SMILES for [6-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-3-pyridinyl]methanamine is C[C@H]1CN(c2ccc(CN)cn2)C[C@H](C)O1.
What is the InChIKey of [6-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-3-pyridinyl]methanamine?
The InChIKey is DKOOGSOFRGBDJP-UWVGGRQHSA-N. The full InChI is InChI=1S/C12H19N3O/c1-9-7-15(8-10(2)16-9)12-4-3-11(5-13)6-14-12/h3-4,6,9-10H,5,7-8,13H2,1-2H3/t9-,10-/m0/s1.
What are the key properties of [6-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-3-pyridinyl]methanamine?
[6-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-3-pyridinyl]methanamine has a molecular weight of 221.30 g/mol, XLogP of 1.15, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-3-pyridinyl]methanamine is sourced from PubChem (CID 30047687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).