3-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-3-yl]propanamide

C14H25N3O3 — CID 120928873

IUPAC3-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-3-yl]propanamide
SMILESC[C@H]1OCCN[C@@H]1C(=O)N1CCCC(CCC(N)=O)C1
InChIInChI=1S/C14H25N3O3/c1-10-13(16-6-8-20-10)14(19)17-7-2-3-11(9-17)4-5-12(15)18/h10-11,13,16H,2-9H2,1H3,(H2,15,18)/t10-,11?,13+/m1/s1
InChIKeyDBUKCENQWQGGKY-XEEJXUNPSA-N
MW283.37 g/mol
LogP-0.13
Rot. Bonds4

About 3-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-3-yl]propanamide

3-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-3-yl]propanamide (PubChem CID 120928873) has the molecular formula C14H25N3O3 and a molecular weight of 283.37 g/mol. Its IUPAC name is 3-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-3-yl]propanamide.

Molecular Properties

Compound Name3-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-3-yl]propanamide
PubChem CID120928873
Molecular FormulaC14H25N3O3
Molecular Weight283.37 g/mol
Exact Mass283.19
IUPAC Name3-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-3-yl]propanamide
SMILESC[C@H]1OCCN[C@@H]1C(=O)N1CCCC(CCC(N)=O)C1
InChIInChI=1S/C14H25N3O3/c1-10-13(16-6-8-20-10)14(19)17-7-2-3-11(9-17)4-5-12(15)18/h10-11,13,16H,2-9H2,1H3,(H2,15,18)/t10-,11?,13+/m1/s1
InChIKeyDBUKCENQWQGGKY-XEEJXUNPSA-N
XLogP-0.13
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 5-0.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-3-yl]methyl]butanamide
CID 120929380
2-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]acetamide
CID 120924842
[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-3-yl]-pyrrolidin-1-ylmethanone
CID 120932585
3-[1-(3-methylpyrrolidine-2-carbonyl)piperidin-3-yl]propanoic acid
CID 102779251
[(2R,3S)-2-methylmorpholin-3-yl]-[3-(2-methylpropyl)pyrrolidin-1-yl]methanone;hydrochloride
CID 120932218
[(2R,3S)-2-methylmorpholin-3-yl]-(2-methyl-1,4-oxazepan-4-yl)methanone;hydrochloride
CID 120930831
[3-(diethylaminomethyl)pyrrolidin-1-yl]-[(2R,3S)-2-methylmorpholin-3-yl]methanone
CID 120942415
[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]-piperidin-1-ylmethanone;hydrochloride
CID 120919129
[3-(2-methoxyethoxymethyl)pyrrolidin-1-yl]-[(2R,3S)-2-methylmorpholin-3-yl]methanone
CID 120935890
3-[(3R)-1-[(4R)-1,3-thiazolidine-4-carbonyl]piperidin-3-yl]propanamide
CID 124592205
1-[4-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperazin-1-yl]ethanone
CID 120916623
[2-(hydroxymethyl)morpholin-4-yl]-[(2R,3S)-2-methylmorpholin-3-yl]methanone;hydrochloride
CID 120932154

Frequently Asked Questions

What is the IUPAC name of 3-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-3-yl]propanamide?
The IUPAC name of 3-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-3-yl]propanamide (CID 120928873) is 3-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-3-yl]propanamide.
What is the SMILES notation for 3-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-3-yl]propanamide?
The canonical SMILES for 3-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-3-yl]propanamide is C[C@H]1OCCN[C@@H]1C(=O)N1CCCC(CCC(N)=O)C1.
What is the InChIKey of 3-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-3-yl]propanamide?
The InChIKey is DBUKCENQWQGGKY-XEEJXUNPSA-N. The full InChI is InChI=1S/C14H25N3O3/c1-10-13(16-6-8-20-10)14(19)17-7-2-3-11(9-17)4-5-12(15)18/h10-11,13,16H,2-9H2,1H3,(H2,15,18)/t10-,11?,13+/m1/s1.
What are the key properties of 3-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-3-yl]propanamide?
3-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-3-yl]propanamide has a molecular weight of 283.37 g/mol, XLogP of -0.13, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-3-yl]propanamide is sourced from PubChem (CID 120928873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).