3-methyl-N-[(2S)-2-morpholin-4-ylpropyl]oxetane-3-carboxamide

C12H22N2O3 — CID 129345062

IUPAC3-methyl-N-[(2S)-2-morpholin-4-ylpropyl]oxetane-3-carboxamide
SMILESC[C@@H](CNC(=O)C1(C)COC1)N1CCOCC1
InChIInChI=1S/C12H22N2O3/c1-10(14-3-5-16-6-4-14)7-13-11(15)12(2)8-17-9-12/h10H,3-9H2,1-2H3,(H,13,15)/t10-/m0/s1
InChIKeyGMXZDTJDZIKJPC-JTQLQIEISA-N
MW242.32 g/mol
LogP-0.14
Rot. Bonds4

About 3-methyl-N-[(2S)-2-morpholin-4-ylpropyl]oxetane-3-carboxamide

3-methyl-N-[(2S)-2-morpholin-4-ylpropyl]oxetane-3-carboxamide (PubChem CID 129345062) has the molecular formula C12H22N2O3 and a molecular weight of 242.32 g/mol. Its IUPAC name is 3-methyl-N-[(2S)-2-morpholin-4-ylpropyl]oxetane-3-carboxamide.

Molecular Properties

Compound Name3-methyl-N-[(2S)-2-morpholin-4-ylpropyl]oxetane-3-carboxamide
PubChem CID129345062
Molecular FormulaC12H22N2O3
Molecular Weight242.32 g/mol
Exact Mass242.16
IUPAC Name3-methyl-N-[(2S)-2-morpholin-4-ylpropyl]oxetane-3-carboxamide
SMILESC[C@@H](CNC(=O)C1(C)COC1)N1CCOCC1
InChIInChI=1S/C12H22N2O3/c1-10(14-3-5-16-6-4-14)7-13-11(15)12(2)8-17-9-12/h10H,3-9H2,1-2H3,(H,13,15)/t10-/m0/s1
InChIKeyGMXZDTJDZIKJPC-JTQLQIEISA-N
XLogP-0.14
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 5-0.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(aminomethyl)-N-(2-morpholin-4-ylpropyl)oxane-4-carboxamide;dihydrochloride
CID 120939123
2-amino-N-(2-morpholin-4-ylpropyl)acetamide
CID 83620199
3-methyl-N-[(3S)-3-(4-methylpiperazin-1-yl)butyl]oxetane-3-carboxamide
CID 125445217
2-methyl-N-(2-morpholin-4-ylpropyl)prop-2-enamide
CID 102248451
4-(methoxymethyl)-N-(2-morpholin-4-ylpropyl)piperidine-4-carboxamide
CID 120642361
(2S)-2-amino-4-methyl-N-(2-morpholin-4-ylpropyl)pentanamide
CID 119849934
5-methyl-N-[(2R)-2-morpholin-4-ylpropyl]pyrazine-2-carboxamide
CID 37248087
4-(methylamino)-N-(2-morpholin-4-ylpropyl)butanamide;dihydrochloride
CID 119849872
1-[(2S)-2-morpholin-4-ylpropyl]-3-[(2R)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]urea
CID 95352106
1-[(2R)-2-morpholin-4-ylpropyl]-3-[(2S)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]urea
CID 95352105
1-ethyl-2-[(1-methylcyclopentyl)methyl]-3-(2-morpholin-4-ylpropyl)guanidine
CID 111760391
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(2-morpholin-4-ylpropyl)cyclopentane-1-carboxamide
CID 56684429

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[(2S)-2-morpholin-4-ylpropyl]oxetane-3-carboxamide?
The IUPAC name of 3-methyl-N-[(2S)-2-morpholin-4-ylpropyl]oxetane-3-carboxamide (CID 129345062) is 3-methyl-N-[(2S)-2-morpholin-4-ylpropyl]oxetane-3-carboxamide.
What is the SMILES notation for 3-methyl-N-[(2S)-2-morpholin-4-ylpropyl]oxetane-3-carboxamide?
The canonical SMILES for 3-methyl-N-[(2S)-2-morpholin-4-ylpropyl]oxetane-3-carboxamide is C[C@@H](CNC(=O)C1(C)COC1)N1CCOCC1.
What is the InChIKey of 3-methyl-N-[(2S)-2-morpholin-4-ylpropyl]oxetane-3-carboxamide?
The InChIKey is GMXZDTJDZIKJPC-JTQLQIEISA-N. The full InChI is InChI=1S/C12H22N2O3/c1-10(14-3-5-16-6-4-14)7-13-11(15)12(2)8-17-9-12/h10H,3-9H2,1-2H3,(H,13,15)/t10-/m0/s1.
What are the key properties of 3-methyl-N-[(2S)-2-morpholin-4-ylpropyl]oxetane-3-carboxamide?
3-methyl-N-[(2S)-2-morpholin-4-ylpropyl]oxetane-3-carboxamide has a molecular weight of 242.32 g/mol, XLogP of -0.14, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[(2S)-2-morpholin-4-ylpropyl]oxetane-3-carboxamide is sourced from PubChem (CID 129345062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).