N-[[4-[2-amino-2-(4-methylphenyl)acetyl]morpholin-2-yl]methyl]acetamide

C16H23N3O3 — CID 120668553

IUPACN-[[4-[2-amino-2-(4-methylphenyl)acetyl]morpholin-2-yl]methyl]acetamide
SMILESCC(=O)NCC1CN(C(=O)C(N)c2ccc(C)cc2)CCO1
InChIInChI=1S/C16H23N3O3/c1-11-3-5-13(6-4-11)15(17)16(21)19-7-8-22-14(10-19)9-18-12(2)20/h3-6,14-15H,7-10,17H2,1-2H3,(H,18,20)
InChIKeyCYDKAMGFYYIDFM-UHFFFAOYSA-N
MW305.38 g/mol
LogP0.36
Rot. Bonds4

About N-[[4-[2-amino-2-(4-methylphenyl)acetyl]morpholin-2-yl]methyl]acetamide

N-[[4-[2-amino-2-(4-methylphenyl)acetyl]morpholin-2-yl]methyl]acetamide (PubChem CID 120668553) has the molecular formula C16H23N3O3 and a molecular weight of 305.38 g/mol. Its IUPAC name is N-[[4-[2-amino-2-(4-methylphenyl)acetyl]morpholin-2-yl]methyl]acetamide.

Molecular Properties

Compound NameN-[[4-[2-amino-2-(4-methylphenyl)acetyl]morpholin-2-yl]methyl]acetamide
PubChem CID120668553
Molecular FormulaC16H23N3O3
Molecular Weight305.38 g/mol
Exact Mass305.17
IUPAC NameN-[[4-[2-amino-2-(4-methylphenyl)acetyl]morpholin-2-yl]methyl]acetamide
SMILESCC(=O)NCC1CN(C(=O)C(N)c2ccc(C)cc2)CCO1
InChIInChI=1S/C16H23N3O3/c1-11-3-5-13(6-4-11)15(17)16(21)19-7-8-22-14(10-19)9-18-12(2)20/h3-6,14-15H,7-10,17H2,1-2H3,(H,18,20)
InChIKeyCYDKAMGFYYIDFM-UHFFFAOYSA-N
XLogP0.36
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 50.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-1-[2-(methoxymethyl)morpholin-4-yl]-2-(4-methylphenyl)ethanone;hydrochloride
CID 120668632
N-[[(2S)-4-[(2R)-2-amino-3-phenylpropanoyl]morpholin-2-yl]methyl]acetamide
CID 124610150
2-amino-N-[(4-methylmorpholin-2-yl)methyl]-2-(4-methylphenyl)acetamide
CID 106312498
2-amino-2-(4-methylphenyl)-N-[[4-(2-methylpropyl)morpholin-2-yl]methyl]acetamide
CID 120669400
(2R)-2-amino-1-[2-(hydroxymethyl)morpholin-4-yl]-2-phenylethanone
CID 81203556
2-amino-1-[2-(hydroxymethyl)morpholin-4-yl]-2-phenylethanone
CID 81203547
N-[[(3S)-1-[(2R)-2-amino-2-phenylacetyl]piperidin-3-yl]methyl]acetamide
CID 124681917
2-amino-2-(4-methylphenyl)-1-(2-thiophen-2-ylmorpholin-4-yl)ethanone;hydrochloride
CID 120668000
2-amino-1-[2-(3,4-difluorophenyl)morpholin-4-yl]-2-(4-methylphenyl)ethanone
CID 120668196
2-amino-1-[2-(2-fluorophenyl)morpholin-4-yl]-2-(4-methylphenyl)ethanone;hydrochloride
CID 120668203
2-amino-1-[2-(3-bromophenyl)morpholin-4-yl]-2-(4-methylphenyl)ethanone
CID 120667995
N-[[4-[4-(2-fluorophenyl)-2-methylbutanoyl]morpholin-2-yl]methyl]acetamide
CID 75374460

Frequently Asked Questions

What is the IUPAC name of N-[[4-[2-amino-2-(4-methylphenyl)acetyl]morpholin-2-yl]methyl]acetamide?
The IUPAC name of N-[[4-[2-amino-2-(4-methylphenyl)acetyl]morpholin-2-yl]methyl]acetamide (CID 120668553) is N-[[4-[2-amino-2-(4-methylphenyl)acetyl]morpholin-2-yl]methyl]acetamide.
What is the SMILES notation for N-[[4-[2-amino-2-(4-methylphenyl)acetyl]morpholin-2-yl]methyl]acetamide?
The canonical SMILES for N-[[4-[2-amino-2-(4-methylphenyl)acetyl]morpholin-2-yl]methyl]acetamide is CC(=O)NCC1CN(C(=O)C(N)c2ccc(C)cc2)CCO1.
What is the InChIKey of N-[[4-[2-amino-2-(4-methylphenyl)acetyl]morpholin-2-yl]methyl]acetamide?
The InChIKey is CYDKAMGFYYIDFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O3/c1-11-3-5-13(6-4-11)15(17)16(21)19-7-8-22-14(10-19)9-18-12(2)20/h3-6,14-15H,7-10,17H2,1-2H3,(H,18,20).
What are the key properties of N-[[4-[2-amino-2-(4-methylphenyl)acetyl]morpholin-2-yl]methyl]acetamide?
N-[[4-[2-amino-2-(4-methylphenyl)acetyl]morpholin-2-yl]methyl]acetamide has a molecular weight of 305.38 g/mol, XLogP of 0.36, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-[2-amino-2-(4-methylphenyl)acetyl]morpholin-2-yl]methyl]acetamide is sourced from PubChem (CID 120668553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).