(2R,3S)-2-methyl-N-(3-oxo-3-piperidin-1-ylpropyl)morpholine-3-carboxamide;hydrochloride

C14H26ClN3O3 — CID 120923595

IUPAC(2R,3S)-2-methyl-N-(3-oxo-3-piperidin-1-ylpropyl)morpholine-3-carboxamide;hydrochloride
SMILESC[C@H]1OCCN[C@@H]1C(=O)NCCC(=O)N1CCCCC1.Cl
InChIInChI=1S/C14H25N3O3.ClH/c1-11-13(15-7-10-20-11)14(19)16-6-5-12(18)17-8-3-2-4-9-17;/h11,13,15H,2-10H2,1H3,(H,16,19);1H/t11-,13+;/m1./s1
InChIKeyFWQVZWGQSPUQLC-YLAFAASESA-N
MW319.83 g/mol
LogP0.30
Rot. Bonds4

About (2R,3S)-2-methyl-N-(3-oxo-3-piperidin-1-ylpropyl)morpholine-3-carboxamide;hydrochloride

(2R,3S)-2-methyl-N-(3-oxo-3-piperidin-1-ylpropyl)morpholine-3-carboxamide;hydrochloride (PubChem CID 120923595) has the molecular formula C14H26ClN3O3 and a molecular weight of 319.83 g/mol. Its IUPAC name is (2R,3S)-2-methyl-N-(3-oxo-3-piperidin-1-ylpropyl)morpholine-3-carboxamide;hydrochloride.

Molecular Properties

Compound Name(2R,3S)-2-methyl-N-(3-oxo-3-piperidin-1-ylpropyl)morpholine-3-carboxamide;hydrochloride
PubChem CID120923595
Molecular FormulaC14H26ClN3O3
Molecular Weight319.83 g/mol
Exact Mass319.17
IUPAC Name(2R,3S)-2-methyl-N-(3-oxo-3-piperidin-1-ylpropyl)morpholine-3-carboxamide;hydrochloride
SMILESC[C@H]1OCCN[C@@H]1C(=O)NCCC(=O)N1CCCCC1.Cl
InChIInChI=1S/C14H25N3O3.ClH/c1-11-13(15-7-10-20-11)14(19)16-6-5-12(18)17-8-3-2-4-9-17;/h11,13,15H,2-10H2,1H3,(H,16,19);1H/t11-,13+;/m1./s1
InChIKeyFWQVZWGQSPUQLC-YLAFAASESA-N
XLogP0.30
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.83
LogP ≤ 50.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2R,3S)-N-[3-(cyclohexylamino)-3-oxopropyl]-2-methylmorpholine-3-carboxamide;hydrochloride
CID 120926749
(2R,3S)-N-(2-aminoethyl)-2-methylmorpholine-3-carboxamide;hydrochloride
CID 131186208
(2R,3S)-2-methyl-N-[(2S)-1-oxo-1-piperidin-1-ylpropan-2-yl]morpholine-3-carboxamide;hydrochloride
CID 120931925
N-ethyl-2-methylmorpholine-3-carboxamide
CID 131071311
(2R,3S)-N-[2-[4-(cyclobutanecarbonyl)piperazin-1-yl]ethyl]-2-methylmorpholine-3-carboxamide
CID 120941888
N-[3-(azepan-1-yl)-3-oxopropyl]morpholine-3-carboxamide
CID 119761881
(2R,3S)-2-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]morpholine-3-carboxamide
CID 120942873
(2R,3S)-N-[3-(tert-butylamino)-3-oxopropyl]-2-methylmorpholine-3-carboxamide
CID 120931039
N-(3-oxo-3-piperidin-1-ylpropyl)morpholine-2-carboxamide
CID 112701632
(2S,4S)-N-[3-(azepan-1-yl)-3-oxopropyl]-2-methylpiperidine-4-carboxamide;hydrochloride
CID 120629082
(2R,3S)-2-methyl-N-[2-(4-methylpiperidin-1-yl)ethyl]morpholine-3-carboxamide
CID 120939222
2-methyl-N-(3-oxo-3-piperidin-1-ylpropyl)piperidine-4-carboxamide
CID 106740605

Frequently Asked Questions

What is the IUPAC name of (2R,3S)-2-methyl-N-(3-oxo-3-piperidin-1-ylpropyl)morpholine-3-carboxamide;hydrochloride?
The IUPAC name of (2R,3S)-2-methyl-N-(3-oxo-3-piperidin-1-ylpropyl)morpholine-3-carboxamide;hydrochloride (CID 120923595) is (2R,3S)-2-methyl-N-(3-oxo-3-piperidin-1-ylpropyl)morpholine-3-carboxamide;hydrochloride.
What is the SMILES notation for (2R,3S)-2-methyl-N-(3-oxo-3-piperidin-1-ylpropyl)morpholine-3-carboxamide;hydrochloride?
The canonical SMILES for (2R,3S)-2-methyl-N-(3-oxo-3-piperidin-1-ylpropyl)morpholine-3-carboxamide;hydrochloride is C[C@H]1OCCN[C@@H]1C(=O)NCCC(=O)N1CCCCC1.Cl.
What is the InChIKey of (2R,3S)-2-methyl-N-(3-oxo-3-piperidin-1-ylpropyl)morpholine-3-carboxamide;hydrochloride?
The InChIKey is FWQVZWGQSPUQLC-YLAFAASESA-N. The full InChI is InChI=1S/C14H25N3O3.ClH/c1-11-13(15-7-10-20-11)14(19)16-6-5-12(18)17-8-3-2-4-9-17;/h11,13,15H,2-10H2,1H3,(H,16,19);1H/t11-,13+;/m1./s1.
What are the key properties of (2R,3S)-2-methyl-N-(3-oxo-3-piperidin-1-ylpropyl)morpholine-3-carboxamide;hydrochloride?
(2R,3S)-2-methyl-N-(3-oxo-3-piperidin-1-ylpropyl)morpholine-3-carboxamide;hydrochloride has a molecular weight of 319.83 g/mol, XLogP of 0.30, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3S)-2-methyl-N-(3-oxo-3-piperidin-1-ylpropyl)morpholine-3-carboxamide;hydrochloride is sourced from PubChem (CID 120923595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).