[(2S,3S)-4-methyl-3-(2-methylpyrazol-3-yl)morpholin-2-yl]methanamine

C10H18N4O — CID 124602691

IUPAC[(2S,3S)-4-methyl-3-(2-methylpyrazol-3-yl)morpholin-2-yl]methanamine
SMILESCN1CCO[C@@H](CN)[C@@H]1c1ccnn1C
InChIInChI=1S/C10H18N4O/c1-13-5-6-15-9(7-11)10(13)8-3-4-12-14(8)2/h3-4,9-10H,5-7,11H2,1-2H3/t9-,10-/m0/s1
InChIKeySZGDBBKCMUERQV-UWVGGRQHSA-N
MW210.28 g/mol
LogP-0.25
Rot. Bonds2

About [(2S,3S)-4-methyl-3-(2-methylpyrazol-3-yl)morpholin-2-yl]methanamine

[(2S,3S)-4-methyl-3-(2-methylpyrazol-3-yl)morpholin-2-yl]methanamine (PubChem CID 124602691) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is [(2S,3S)-4-methyl-3-(2-methylpyrazol-3-yl)morpholin-2-yl]methanamine.

Molecular Properties

Compound Name[(2S,3S)-4-methyl-3-(2-methylpyrazol-3-yl)morpholin-2-yl]methanamine
PubChem CID124602691
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC Name[(2S,3S)-4-methyl-3-(2-methylpyrazol-3-yl)morpholin-2-yl]methanamine
SMILESCN1CCO[C@@H](CN)[C@@H]1c1ccnn1C
InChIInChI=1S/C10H18N4O/c1-13-5-6-15-9(7-11)10(13)8-3-4-12-14(8)2/h3-4,9-10H,5-7,11H2,1-2H3/t9-,10-/m0/s1
InChIKeySZGDBBKCMUERQV-UWVGGRQHSA-N
XLogP-0.25
TPSA56.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 5-0.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[(2R,3R)-4-methyl-3-phenylmorpholin-2-yl]methanamine
CID 124832574
N-[[3-(2-ethylpyrazol-3-yl)-4-methylmorpholin-2-yl]methyl]propan-2-amine
CID 114557715
2-methyl-N-[[(2S,3S)-4-methyl-3-(3-methylimidazol-4-yl)morpholin-2-yl]methyl]pyrazole-3-sulfonamide
CID 154761061
[(1S,3S)-2,2-dimethyl-3-(2-methylpyrazol-3-yl)cyclopropyl]methanamine
CID 178197771
2-(2-methylpyrazol-3-yl)-4-propylsulfonylmorpholine
CID 138051484
[4-propan-2-yl-3-(1-propylpyrazol-4-yl)morpholin-2-yl]methanamine
CID 103573225
1,1,3,3-tetramethyl-2-[[(2R,3S)-1-methyl-2-(2-methylpyrazol-3-yl)piperidin-3-yl]methyl]guanidine
CID 120972925
[(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]methanol
CID 130949666
2-imidazol-1-yl-N-methyl-N-[[(2R,3S)-1-methyl-2-(2-methylpyrazol-3-yl)piperidin-3-yl]methyl]ethanamine
CID 128987589
N-methyl-1-[(2S,3S)-4-methyl-3-(1-methylpyrazol-4-yl)morpholin-2-yl]methanamine
CID 122164329
N-[[4-methyl-3-(3-methylimidazol-4-yl)morpholin-2-yl]methyl]propan-2-amine
CID 66118550
2-methyl-N-[[(2R,3S)-1-methyl-2-(2-methylpyrazol-3-yl)piperidin-3-yl]methyl]pyrazole-3-sulfonamide
CID 128977860

Frequently Asked Questions

What is the IUPAC name of [(2S,3S)-4-methyl-3-(2-methylpyrazol-3-yl)morpholin-2-yl]methanamine?
The IUPAC name of [(2S,3S)-4-methyl-3-(2-methylpyrazol-3-yl)morpholin-2-yl]methanamine (CID 124602691) is [(2S,3S)-4-methyl-3-(2-methylpyrazol-3-yl)morpholin-2-yl]methanamine.
What is the SMILES notation for [(2S,3S)-4-methyl-3-(2-methylpyrazol-3-yl)morpholin-2-yl]methanamine?
The canonical SMILES for [(2S,3S)-4-methyl-3-(2-methylpyrazol-3-yl)morpholin-2-yl]methanamine is CN1CCO[C@@H](CN)[C@@H]1c1ccnn1C.
What is the InChIKey of [(2S,3S)-4-methyl-3-(2-methylpyrazol-3-yl)morpholin-2-yl]methanamine?
The InChIKey is SZGDBBKCMUERQV-UWVGGRQHSA-N. The full InChI is InChI=1S/C10H18N4O/c1-13-5-6-15-9(7-11)10(13)8-3-4-12-14(8)2/h3-4,9-10H,5-7,11H2,1-2H3/t9-,10-/m0/s1.
What are the key properties of [(2S,3S)-4-methyl-3-(2-methylpyrazol-3-yl)morpholin-2-yl]methanamine?
[(2S,3S)-4-methyl-3-(2-methylpyrazol-3-yl)morpholin-2-yl]methanamine has a molecular weight of 210.28 g/mol, XLogP of -0.25, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S,3S)-4-methyl-3-(2-methylpyrazol-3-yl)morpholin-2-yl]methanamine is sourced from PubChem (CID 124602691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).