2-[4-[(2R)-4-benzyl-2-methyl-5-oxomorpholin-2-yl]piperidin-1-yl]acetamide

C19H27N3O3 — CID 124950770

IUPAC2-[4-[(2R)-4-benzyl-2-methyl-5-oxomorpholin-2-yl]piperidin-1-yl]acetamide
SMILESC[C@@]1(C2CCN(CC(N)=O)CC2)CN(Cc2ccccc2)C(=O)CO1
InChIInChI=1S/C19H27N3O3/c1-19(16-7-9-21(10-8-16)12-17(20)23)14-22(18(24)13-25-19)11-15-5-3-2-4-6-15/h2-6,16H,7-14H2,1H3,(H2,20,23)/t19-/m0/s1
InChIKeyDDWLBFFGTBMINM-IBGZPJMESA-N
MW345.44 g/mol
LogP1.00
Rot. Bonds5

About 2-[4-[(2R)-4-benzyl-2-methyl-5-oxomorpholin-2-yl]piperidin-1-yl]acetamide

2-[4-[(2R)-4-benzyl-2-methyl-5-oxomorpholin-2-yl]piperidin-1-yl]acetamide (PubChem CID 124950770) has the molecular formula C19H27N3O3 and a molecular weight of 345.44 g/mol. Its IUPAC name is 2-[4-[(2R)-4-benzyl-2-methyl-5-oxomorpholin-2-yl]piperidin-1-yl]acetamide.

Molecular Properties

Compound Name2-[4-[(2R)-4-benzyl-2-methyl-5-oxomorpholin-2-yl]piperidin-1-yl]acetamide
PubChem CID124950770
Molecular FormulaC19H27N3O3
Molecular Weight345.44 g/mol
Exact Mass345.21
IUPAC Name2-[4-[(2R)-4-benzyl-2-methyl-5-oxomorpholin-2-yl]piperidin-1-yl]acetamide
SMILESC[C@@]1(C2CCN(CC(N)=O)CC2)CN(Cc2ccccc2)C(=O)CO1
InChIInChI=1S/C19H27N3O3/c1-19(16-7-9-21(10-8-16)12-17(20)23)14-22(18(24)13-25-19)11-15-5-3-2-4-6-15/h2-6,16H,7-14H2,1H3,(H2,20,23)/t19-/m0/s1
InChIKeyDDWLBFFGTBMINM-IBGZPJMESA-N
XLogP1.00
TPSA75.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.44
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-(2-methyl-5-oxo-4-phenylmorpholin-2-yl)piperidin-1-yl]acetamide
CID 110109800
2-[2-[4-[(2R)-4-benzyl-2-methyl-5-oxomorpholin-2-yl]piperidine-1-carbonyl]phenoxy]acetic acid
CID 124973649
4-[(3-methoxyphenyl)methyl]-6-methyl-6-piperidin-4-ylmorpholin-3-one
CID 115067815
2-(4-benzylpiperidin-1-yl)acetamide
CID 6465422
1-benzyl-3-methyl-3-[1-(2-oxo-2-pyrrolidin-1-ylethyl)piperidin-4-yl]azepan-2-one
CID 110261947
(4R)-1-benzyl-4-hydroxy-4-methylpyrrolidin-2-one
CID 98042329
4-[(3-fluorophenyl)methyl]-6-methyl-6-pyrrolidin-3-ylmorpholin-3-one
CID 115067984
3-[[2-[4-[(2S)-2-methyl-5-oxo-4-phenylmorpholin-2-yl]piperidin-1-yl]acetyl]amino]benzoic acid
CID 124993571
2-[4-(4-benzylpiperazine-1-carbonyl)piperidin-1-yl]acetamide
CID 16909130
4'-benzylspiro[8-azabicyclo[3.2.1]octane-3,6'-morpholine]-3'-one
CID 91812260
3-benzyl-3-azabicyclo[4.1.0]heptan-1-amine
CID 82658680
(1S,6R)-3-benzyl-1-methyl-7-oxa-3-azabicyclo[4.1.0]heptane
CID 24861877

Frequently Asked Questions

What is the IUPAC name of 2-[4-[(2R)-4-benzyl-2-methyl-5-oxomorpholin-2-yl]piperidin-1-yl]acetamide?
The IUPAC name of 2-[4-[(2R)-4-benzyl-2-methyl-5-oxomorpholin-2-yl]piperidin-1-yl]acetamide (CID 124950770) is 2-[4-[(2R)-4-benzyl-2-methyl-5-oxomorpholin-2-yl]piperidin-1-yl]acetamide.
What is the SMILES notation for 2-[4-[(2R)-4-benzyl-2-methyl-5-oxomorpholin-2-yl]piperidin-1-yl]acetamide?
The canonical SMILES for 2-[4-[(2R)-4-benzyl-2-methyl-5-oxomorpholin-2-yl]piperidin-1-yl]acetamide is C[C@@]1(C2CCN(CC(N)=O)CC2)CN(Cc2ccccc2)C(=O)CO1.
What is the InChIKey of 2-[4-[(2R)-4-benzyl-2-methyl-5-oxomorpholin-2-yl]piperidin-1-yl]acetamide?
The InChIKey is DDWLBFFGTBMINM-IBGZPJMESA-N. The full InChI is InChI=1S/C19H27N3O3/c1-19(16-7-9-21(10-8-16)12-17(20)23)14-22(18(24)13-25-19)11-15-5-3-2-4-6-15/h2-6,16H,7-14H2,1H3,(H2,20,23)/t19-/m0/s1.
What are the key properties of 2-[4-[(2R)-4-benzyl-2-methyl-5-oxomorpholin-2-yl]piperidin-1-yl]acetamide?
2-[4-[(2R)-4-benzyl-2-methyl-5-oxomorpholin-2-yl]piperidin-1-yl]acetamide has a molecular weight of 345.44 g/mol, XLogP of 1.00, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(2R)-4-benzyl-2-methyl-5-oxomorpholin-2-yl]piperidin-1-yl]acetamide is sourced from PubChem (CID 124950770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).