3-(2-methoxyethoxy)-N-[1-(5-phenyl-1H-imidazol-2-yl)propyl]propanamide

C18H25N3O3 — CID 51099230

IUPAC3-(2-methoxyethoxy)-N-[1-(5-phenyl-1H-imidazol-2-yl)propyl]propanamide
SMILESCCC(NC(=O)CCOCCOC)c1ncc(-c2ccccc2)[nH]1
InChIInChI=1S/C18H25N3O3/c1-3-15(20-17(22)9-10-24-12-11-23-2)18-19-13-16(21-18)14-7-5-4-6-8-14/h4-8,13,15H,3,9-12H2,1-2H3,(H,19,21)(H,20,22)
InChIKeyRVLOZAMMYMSKCE-UHFFFAOYSA-N
MW331.42 g/mol
LogP2.70
Rot. Bonds10

About 3-(2-methoxyethoxy)-N-[1-(5-phenyl-1H-imidazol-2-yl)propyl]propanamide

3-(2-methoxyethoxy)-N-[1-(5-phenyl-1H-imidazol-2-yl)propyl]propanamide (PubChem CID 51099230) has the molecular formula C18H25N3O3 and a molecular weight of 331.42 g/mol. Its IUPAC name is 3-(2-methoxyethoxy)-N-[1-(5-phenyl-1H-imidazol-2-yl)propyl]propanamide.

Molecular Properties

Compound Name3-(2-methoxyethoxy)-N-[1-(5-phenyl-1H-imidazol-2-yl)propyl]propanamide
PubChem CID51099230
Molecular FormulaC18H25N3O3
Molecular Weight331.42 g/mol
Exact Mass331.19
IUPAC Name3-(2-methoxyethoxy)-N-[1-(5-phenyl-1H-imidazol-2-yl)propyl]propanamide
SMILESCCC(NC(=O)CCOCCOC)c1ncc(-c2ccccc2)[nH]1
InChIInChI=1S/C18H25N3O3/c1-3-15(20-17(22)9-10-24-12-11-23-2)18-19-13-16(21-18)14-7-5-4-6-8-14/h4-8,13,15H,3,9-12H2,1-2H3,(H,19,21)(H,20,22)
InChIKeyRVLOZAMMYMSKCE-UHFFFAOYSA-N
XLogP2.70
TPSA76.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.42
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-(2-methoxyethoxy)-N-[(1R)-1-(5-phenyl-1H-imidazol-2-yl)propyl]propanamide
CID 94821044
N-[(1S)-1-(5-phenyl-1H-imidazol-2-yl)propyl]-3-propan-2-yloxypropanamide
CID 94814571
N-[1-(5-phenyl-1H-imidazol-2-yl)propyl]-3-(pyrimidin-2-ylamino)propanamide
CID 51128542
3-[2-oxo-2-[[(1S)-1-(5-phenyl-1H-imidazol-2-yl)propyl]amino]ethoxy]benzamide
CID 52516393
(2R)-2-(2-ethoxyethoxy)-N-[(1S)-1-(5-phenyl-1H-imidazol-2-yl)ethyl]propanamide
CID 94823273
2-[methyl(pyrazin-2-yl)amino]-N-[1-(5-phenyl-1H-imidazol-2-yl)propyl]acetamide
CID 51128541
3-[(1,1-dioxo-1,2-benzothiazol-3-ylidene)amino]-N-[1-(5-phenyl-1H-imidazol-2-yl)propyl]propanamide
CID 135992659
N-[(2R)-1-oxo-1-[[(1S)-1-(5-phenyl-1H-imidazol-2-yl)propyl]amino]propan-2-yl]furan-2-carboxamide
CID 52512368
N-[4-amino-1-(5-phenyl-1H-imidazol-2-yl)butyl]-2-methoxybenzamide
CID 170342320
4-oxo-N-[(1S)-1-(5-phenyl-1H-imidazol-2-yl)propyl]pyrido[1,2-a]pyrimidine-3-carboxamide
CID 94812869
1-(5-methyl-1,2-oxazol-3-yl)-3-[1-(5-phenyl-1H-imidazol-2-yl)propyl]urea
CID 47076390
(E)-N-[(1R)-1-(5-phenyl-1H-imidazol-2-yl)propyl]-3-pyridin-3-ylprop-2-enamide
CID 95304316

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyethoxy)-N-[1-(5-phenyl-1H-imidazol-2-yl)propyl]propanamide?
The IUPAC name of 3-(2-methoxyethoxy)-N-[1-(5-phenyl-1H-imidazol-2-yl)propyl]propanamide (CID 51099230) is 3-(2-methoxyethoxy)-N-[1-(5-phenyl-1H-imidazol-2-yl)propyl]propanamide.
What is the SMILES notation for 3-(2-methoxyethoxy)-N-[1-(5-phenyl-1H-imidazol-2-yl)propyl]propanamide?
The canonical SMILES for 3-(2-methoxyethoxy)-N-[1-(5-phenyl-1H-imidazol-2-yl)propyl]propanamide is CCC(NC(=O)CCOCCOC)c1ncc(-c2ccccc2)[nH]1.
What is the InChIKey of 3-(2-methoxyethoxy)-N-[1-(5-phenyl-1H-imidazol-2-yl)propyl]propanamide?
The InChIKey is RVLOZAMMYMSKCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3O3/c1-3-15(20-17(22)9-10-24-12-11-23-2)18-19-13-16(21-18)14-7-5-4-6-8-14/h4-8,13,15H,3,9-12H2,1-2H3,(H,19,21)(H,20,22).
What are the key properties of 3-(2-methoxyethoxy)-N-[1-(5-phenyl-1H-imidazol-2-yl)propyl]propanamide?
3-(2-methoxyethoxy)-N-[1-(5-phenyl-1H-imidazol-2-yl)propyl]propanamide has a molecular weight of 331.42 g/mol, XLogP of 2.70, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyethoxy)-N-[1-(5-phenyl-1H-imidazol-2-yl)propyl]propanamide is sourced from PubChem (CID 51099230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).