N-[2-[2-[5-[(dimethylamino)methyl]-1H-imidazol-2-yl]morpholin-4-yl]-2-oxoethyl]acetamide

C14H23N5O3 — CID 110117072

IUPACN-[2-[2-[5-[(dimethylamino)methyl]-1H-imidazol-2-yl]morpholin-4-yl]-2-oxoethyl]acetamide
SMILESCC(=O)NCC(=O)N1CCOC(c2ncc(CN(C)C)[nH]2)C1
InChIInChI=1S/C14H23N5O3/c1-10(20)15-7-13(21)19-4-5-22-12(9-19)14-16-6-11(17-14)8-18(2)3/h6,12H,4-5,7-9H2,1-3H3,(H,15,20)(H,16,17)
InChIKeyJDOUVJMBDYITIL-UHFFFAOYSA-N
MW309.37 g/mol
LogP-0.49
Rot. Bonds5

About N-[2-[2-[5-[(dimethylamino)methyl]-1H-imidazol-2-yl]morpholin-4-yl]-2-oxoethyl]acetamide

N-[2-[2-[5-[(dimethylamino)methyl]-1H-imidazol-2-yl]morpholin-4-yl]-2-oxoethyl]acetamide (PubChem CID 110117072) has the molecular formula C14H23N5O3 and a molecular weight of 309.37 g/mol. Its IUPAC name is N-[2-[2-[5-[(dimethylamino)methyl]-1H-imidazol-2-yl]morpholin-4-yl]-2-oxoethyl]acetamide.

Molecular Properties

Compound NameN-[2-[2-[5-[(dimethylamino)methyl]-1H-imidazol-2-yl]morpholin-4-yl]-2-oxoethyl]acetamide
PubChem CID110117072
Molecular FormulaC14H23N5O3
Molecular Weight309.37 g/mol
Exact Mass309.18
IUPAC NameN-[2-[2-[5-[(dimethylamino)methyl]-1H-imidazol-2-yl]morpholin-4-yl]-2-oxoethyl]acetamide
SMILESCC(=O)NCC(=O)N1CCOC(c2ncc(CN(C)C)[nH]2)C1
InChIInChI=1S/C14H23N5O3/c1-10(20)15-7-13(21)19-4-5-22-12(9-19)14-16-6-11(17-14)8-18(2)3/h6,12H,4-5,7-9H2,1-3H3,(H,15,20)(H,16,17)
InChIKeyJDOUVJMBDYITIL-UHFFFAOYSA-N
XLogP-0.49
TPSA90.56 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 5-0.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[[2-[4-(2-thiophen-3-ylacetyl)morpholin-2-yl]-1H-imidazol-5-yl]methyl]acetamide
CID 110117117
N-[[2-[(2S)-4-(pyridine-2-carbonyl)morpholin-2-yl]-1H-imidazol-5-yl]methyl]acetamide
CID 125021716
N-[[2-[(2S)-4-[(E)-3-phenylprop-2-enoyl]morpholin-2-yl]-1H-imidazol-5-yl]methyl]acetamide
CID 124948396
N-[[2-[4-(5-ethyl-1,2-oxazole-3-carbonyl)morpholin-2-yl]-1H-imidazol-5-yl]methyl]acetamide
CID 110117119
[4-[(dimethylamino)methyl]phenyl]-[(2R)-2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]methanone
CID 125003588
1-[2-[4-(cyclohexylmethyl)morpholin-2-yl]-1H-imidazol-5-yl]-N,N-dimethylmethanamine
CID 110117065
2-cyclopropyl-1-[2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]ethanone
CID 73439823
1-[(2S)-2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]-2-morpholin-4-ylethanone
CID 124953608
1-[(2S)-2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]-3-thiophen-2-ylpropan-1-one
CID 124960617
N,N-dimethyl-1-[2-[(2S)-4-[(6-methyl-2-pyridinyl)methyl]morpholin-2-yl]-1H-imidazol-5-yl]methanamine
CID 124969049
1-[(2R)-2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]-3-phenylpropan-1-one
CID 124972553
N-[2-[(2S)-2-[6-[(2,6-difluorophenyl)methyl]-2-pyridinyl]morpholin-4-yl]-2-oxoethyl]acetamide
CID 125007892

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-[5-[(dimethylamino)methyl]-1H-imidazol-2-yl]morpholin-4-yl]-2-oxoethyl]acetamide?
The IUPAC name of N-[2-[2-[5-[(dimethylamino)methyl]-1H-imidazol-2-yl]morpholin-4-yl]-2-oxoethyl]acetamide (CID 110117072) is N-[2-[2-[5-[(dimethylamino)methyl]-1H-imidazol-2-yl]morpholin-4-yl]-2-oxoethyl]acetamide.
What is the SMILES notation for N-[2-[2-[5-[(dimethylamino)methyl]-1H-imidazol-2-yl]morpholin-4-yl]-2-oxoethyl]acetamide?
The canonical SMILES for N-[2-[2-[5-[(dimethylamino)methyl]-1H-imidazol-2-yl]morpholin-4-yl]-2-oxoethyl]acetamide is CC(=O)NCC(=O)N1CCOC(c2ncc(CN(C)C)[nH]2)C1.
What is the InChIKey of N-[2-[2-[5-[(dimethylamino)methyl]-1H-imidazol-2-yl]morpholin-4-yl]-2-oxoethyl]acetamide?
The InChIKey is JDOUVJMBDYITIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5O3/c1-10(20)15-7-13(21)19-4-5-22-12(9-19)14-16-6-11(17-14)8-18(2)3/h6,12H,4-5,7-9H2,1-3H3,(H,15,20)(H,16,17).
What are the key properties of N-[2-[2-[5-[(dimethylamino)methyl]-1H-imidazol-2-yl]morpholin-4-yl]-2-oxoethyl]acetamide?
N-[2-[2-[5-[(dimethylamino)methyl]-1H-imidazol-2-yl]morpholin-4-yl]-2-oxoethyl]acetamide has a molecular weight of 309.37 g/mol, XLogP of -0.49, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-[5-[(dimethylamino)methyl]-1H-imidazol-2-yl]morpholin-4-yl]-2-oxoethyl]acetamide is sourced from PubChem (CID 110117072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).