(3S)-3-[[(2S)-2-methylpiperidin-1-yl]methyl]morpholine

C11H22N2O — CID 124746471

IUPAC(3S)-3-[[(2S)-2-methylpiperidin-1-yl]methyl]morpholine
SMILESC[C@H]1CCCCN1C[C@H]1COCCN1
InChIInChI=1S/C11H22N2O/c1-10-4-2-3-6-13(10)8-11-9-14-7-5-12-11/h10-12H,2-9H2,1H3/t10-,11-/m0/s1
InChIKeyLOKLVVRXLVWIQB-QWRGUYRKSA-N
MW198.31 g/mol
LogP0.85
Rot. Bonds2

About (3S)-3-[[(2S)-2-methylpiperidin-1-yl]methyl]morpholine

(3S)-3-[[(2S)-2-methylpiperidin-1-yl]methyl]morpholine (PubChem CID 124746471) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is (3S)-3-[[(2S)-2-methylpiperidin-1-yl]methyl]morpholine.

Molecular Properties

Compound Name(3S)-3-[[(2S)-2-methylpiperidin-1-yl]methyl]morpholine
PubChem CID124746471
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name(3S)-3-[[(2S)-2-methylpiperidin-1-yl]methyl]morpholine
SMILESC[C@H]1CCCCN1C[C@H]1COCCN1
InChIInChI=1S/C11H22N2O/c1-10-4-2-3-6-13(10)8-11-9-14-7-5-12-11/h10-12H,2-9H2,1H3/t10-,11-/m0/s1
InChIKeyLOKLVVRXLVWIQB-QWRGUYRKSA-N
XLogP0.85
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-Morpholinopiperidine
CID 795724
Hexyl[2-(morpholin-4-yl)ethyl]amine
CID 21278415
rac-(4aR,8aS)-4-methyl-octahydro-2H-pyrido(4,3-b)(1,4)oxazine
CID 90430723
N-[2-(morpholin-4-yl)ethyl]cyclopentanamine
CID 12077343
1-[2-(Piperidin-4-yloxy)ethyl]piperidine
CID 43167822
1-(2-(Morpholin-4-yl)ethyl)piperidin-3-amine
CID 54593784
(2R,6S)-2,6-dimethyl-4-(piperidin-4-yl)morpholine
CID 795717
4-((Piperidin-2-yl)methyl)morpholine
CID 3163395
2-(Morpholin-4-yl)cyclohexan-1-amine
CID 12447267
4-(Piperidin-4-yl)morpholine dihydrochloride
CID 18002293
4-(Piperidin-3-yl)morpholine dihydrochloride
CID 53409897
2-(Piperazin-1-ylmethyl)-4-(propan-2-yl)morpholine
CID 54592597

Frequently Asked Questions

What is the IUPAC name of (3S)-3-[[(2S)-2-methylpiperidin-1-yl]methyl]morpholine?
The IUPAC name of (3S)-3-[[(2S)-2-methylpiperidin-1-yl]methyl]morpholine (CID 124746471) is (3S)-3-[[(2S)-2-methylpiperidin-1-yl]methyl]morpholine.
What is the SMILES notation for (3S)-3-[[(2S)-2-methylpiperidin-1-yl]methyl]morpholine?
The canonical SMILES for (3S)-3-[[(2S)-2-methylpiperidin-1-yl]methyl]morpholine is C[C@H]1CCCCN1C[C@H]1COCCN1.
What is the InChIKey of (3S)-3-[[(2S)-2-methylpiperidin-1-yl]methyl]morpholine?
The InChIKey is LOKLVVRXLVWIQB-QWRGUYRKSA-N. The full InChI is InChI=1S/C11H22N2O/c1-10-4-2-3-6-13(10)8-11-9-14-7-5-12-11/h10-12H,2-9H2,1H3/t10-,11-/m0/s1.
What are the key properties of (3S)-3-[[(2S)-2-methylpiperidin-1-yl]methyl]morpholine?
(3S)-3-[[(2S)-2-methylpiperidin-1-yl]methyl]morpholine has a molecular weight of 198.31 g/mol, XLogP of 0.85, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-3-[[(2S)-2-methylpiperidin-1-yl]methyl]morpholine is sourced from PubChem (CID 124746471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).