N-[[4-(dimethylamino)phenyl]methyl]-N-methyl-2-morpholin-2-ylacetamide

C16H25N3O2 — CID 66428059

IUPACN-[[4-(dimethylamino)phenyl]methyl]-N-methyl-2-morpholin-2-ylacetamide
SMILESCN(Cc1ccc(N(C)C)cc1)C(=O)CC1CNCCO1
InChIInChI=1S/C16H25N3O2/c1-18(2)14-6-4-13(5-7-14)12-19(3)16(20)10-15-11-17-8-9-21-15/h4-7,15,17H,8-12H2,1-3H3
InChIKeyNYZFHRATXKYGDB-UHFFFAOYSA-N
MW291.39 g/mol
LogP1.09
Rot. Bonds5

About N-[[4-(dimethylamino)phenyl]methyl]-N-methyl-2-morpholin-2-ylacetamide

N-[[4-(dimethylamino)phenyl]methyl]-N-methyl-2-morpholin-2-ylacetamide (PubChem CID 66428059) has the molecular formula C16H25N3O2 and a molecular weight of 291.39 g/mol. Its IUPAC name is N-[[4-(dimethylamino)phenyl]methyl]-N-methyl-2-morpholin-2-ylacetamide.

Molecular Properties

Compound NameN-[[4-(dimethylamino)phenyl]methyl]-N-methyl-2-morpholin-2-ylacetamide
PubChem CID66428059
Molecular FormulaC16H25N3O2
Molecular Weight291.39 g/mol
Exact Mass291.19
IUPAC NameN-[[4-(dimethylamino)phenyl]methyl]-N-methyl-2-morpholin-2-ylacetamide
SMILESCN(Cc1ccc(N(C)C)cc1)C(=O)CC1CNCCO1
InChIInChI=1S/C16H25N3O2/c1-18(2)14-6-4-13(5-7-14)12-19(3)16(20)10-15-11-17-8-9-21-15/h4-7,15,17H,8-12H2,1-3H3
InChIKeyNYZFHRATXKYGDB-UHFFFAOYSA-N
XLogP1.09
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.39
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_D(198)', 'substructure': 'N/A'}, {'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

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Related Compounds

N-methyl-2-morpholin-2-yl-N-[(4-phenoxyphenyl)methyl]acetamide
CID 70776717
N-[(3-hydroxyphenyl)methyl]-N-methyl-2-morpholin-2-ylacetamide
CID 66427007
N-methyl-N-[(3-methylphenyl)methyl]-2-morpholin-2-ylacetamide
CID 66429127
N-methyl-N-[(2-methylphenyl)methyl]-2-morpholin-2-ylacetamide
CID 66433193
N-[(2-chlorophenyl)methyl]-N-methyl-2-morpholin-2-ylacetamide
CID 66429544
N-benzyl-2-morpholin-2-yl-N-propylacetamide
CID 66433391
N-methyl-2-morpholin-2-yl-N-(1H-1,2,4-triazol-5-ylmethyl)acetamide
CID 66428762
N-butyl-N-methyl-2-morpholin-2-ylacetamide
CID 66433567
N-methyl-N-[2-(5-methylfuran-2-yl)ethyl]-2-morpholin-2-ylacetamide
CID 115178233
N-methyl-2-morpholin-2-yl-N-propan-2-ylacetamide
CID 66434341
N-[(3-chloro-1-benzothiophen-2-yl)methyl]-N-methyl-2-morpholin-2-ylacetamide;hydrochloride
CID 154903609
N-methyl-2-morpholin-2-yl-N-(2-phenoxyethyl)acetamide;hydrochloride
CID 119680862

Frequently Asked Questions

What is the IUPAC name of N-[[4-(dimethylamino)phenyl]methyl]-N-methyl-2-morpholin-2-ylacetamide?
The IUPAC name of N-[[4-(dimethylamino)phenyl]methyl]-N-methyl-2-morpholin-2-ylacetamide (CID 66428059) is N-[[4-(dimethylamino)phenyl]methyl]-N-methyl-2-morpholin-2-ylacetamide.
What is the SMILES notation for N-[[4-(dimethylamino)phenyl]methyl]-N-methyl-2-morpholin-2-ylacetamide?
The canonical SMILES for N-[[4-(dimethylamino)phenyl]methyl]-N-methyl-2-morpholin-2-ylacetamide is CN(Cc1ccc(N(C)C)cc1)C(=O)CC1CNCCO1.
What is the InChIKey of N-[[4-(dimethylamino)phenyl]methyl]-N-methyl-2-morpholin-2-ylacetamide?
The InChIKey is NYZFHRATXKYGDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O2/c1-18(2)14-6-4-13(5-7-14)12-19(3)16(20)10-15-11-17-8-9-21-15/h4-7,15,17H,8-12H2,1-3H3.
What are the key properties of N-[[4-(dimethylamino)phenyl]methyl]-N-methyl-2-morpholin-2-ylacetamide?
N-[[4-(dimethylamino)phenyl]methyl]-N-methyl-2-morpholin-2-ylacetamide has a molecular weight of 291.39 g/mol, XLogP of 1.09, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(dimethylamino)phenyl]methyl]-N-methyl-2-morpholin-2-ylacetamide is sourced from PubChem (CID 66428059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).