[2-(2-ethoxyethoxy)phenyl]-[3-(1H-imidazol-2-yl)piperidin-1-yl]methanone

C19H25N3O3 — CID 70710484

IUPAC[2-(2-ethoxyethoxy)phenyl]-[3-(1H-imidazol-2-yl)piperidin-1-yl]methanone
SMILESCCOCCOc1ccccc1C(=O)N1CCCC(c2ncc[nH]2)C1
InChIInChI=1S/C19H25N3O3/c1-2-24-12-13-25-17-8-4-3-7-16(17)19(23)22-11-5-6-15(14-22)18-20-9-10-21-18/h3-4,7-10,15H,2,5-6,11-14H2,1H3,(H,20,21)
InChIKeyJNRCJLIIQSDFRO-UHFFFAOYSA-N
MW343.43 g/mol
LogP2.84
Rot. Bonds7

About [2-(2-ethoxyethoxy)phenyl]-[3-(1H-imidazol-2-yl)piperidin-1-yl]methanone

[2-(2-ethoxyethoxy)phenyl]-[3-(1H-imidazol-2-yl)piperidin-1-yl]methanone (PubChem CID 70710484) has the molecular formula C19H25N3O3 and a molecular weight of 343.43 g/mol. Its IUPAC name is [2-(2-ethoxyethoxy)phenyl]-[3-(1H-imidazol-2-yl)piperidin-1-yl]methanone.

Molecular Properties

Compound Name[2-(2-ethoxyethoxy)phenyl]-[3-(1H-imidazol-2-yl)piperidin-1-yl]methanone
PubChem CID70710484
Molecular FormulaC19H25N3O3
Molecular Weight343.43 g/mol
Exact Mass343.19
IUPAC Name[2-(2-ethoxyethoxy)phenyl]-[3-(1H-imidazol-2-yl)piperidin-1-yl]methanone
SMILESCCOCCOc1ccccc1C(=O)N1CCCC(c2ncc[nH]2)C1
InChIInChI=1S/C19H25N3O3/c1-2-24-12-13-25-17-8-4-3-7-16(17)19(23)22-11-5-6-15(14-22)18-20-9-10-21-18/h3-4,7-10,15H,2,5-6,11-14H2,1H3,(H,20,21)
InChIKeyJNRCJLIIQSDFRO-UHFFFAOYSA-N
XLogP2.84
TPSA67.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.43
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze [2-(2-ethoxyethoxy)phenyl]-[3-(1H-imidazol-2-yl)piperidin-1-yl]methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(hexyloxy)-N-[3-(1H-imidazol-1-yl)propyl]benzamide
CID 4199636
2-ethoxy-N-[3-(1H-imidazol-1-yl)propyl]benzamide
CID 2931168
{4-[2-(1H-Imidazol-4-yl)-ethoxy]-phenyl}-piperidin-1-yl-methanone
CID 10661883
1-[(2-methoxyphenyl)methyl]-N-[(1-methylimidazol-2-yl)methyl]-6-oxopiperidine-3-carboxamide
CID 24791703
(4-(3-(4-((1H-imidazol-4-yl)methyl)piperidin-1-yl)propoxy)phenyl)(piperazin-1-yl)methanone
CID 44407899
1-(4-((1H-imidazol-4-yl)methyl)piperidin-1-yl)-3-(4-(piperazine-1-carbonyl)phenoxy)propan-1-one
CID 44407949
(4-(3-(4-((1H-imidazol-4-yl)methyl)piperidin-1-yl)propoxy)phenyl)(piperidin-1-yl)methanone
CID 44408015
N-[(1E)-3-{[3-(1H-imidazol-1-yl)propyl]amino}-1-(2-methoxyphenyl)-3-oxoprop-1-en-2-yl]benzamide
CID 5909859
(E)-N-[3-(1H-imidazol-1-yl)propyl]-3-(2-methoxyphenyl)-2-phenyl-2-propenamide
CID 6078143
N-[3-(1H-imidazol-1-yl)propyl]-4-propoxybenzamide
CID 3238852
4-ethoxy-N-(3-imidazol-1-ylpropyl)benzamide
CID 3246743
2-ethoxy-N-[2-(1H-imidazol-5-yl)ethyl]benzamide
CID 17579817

Frequently Asked Questions

What is the IUPAC name of [2-(2-ethoxyethoxy)phenyl]-[3-(1H-imidazol-2-yl)piperidin-1-yl]methanone?
The IUPAC name of [2-(2-ethoxyethoxy)phenyl]-[3-(1H-imidazol-2-yl)piperidin-1-yl]methanone (CID 70710484) is [2-(2-ethoxyethoxy)phenyl]-[3-(1H-imidazol-2-yl)piperidin-1-yl]methanone.
What is the SMILES notation for [2-(2-ethoxyethoxy)phenyl]-[3-(1H-imidazol-2-yl)piperidin-1-yl]methanone?
The canonical SMILES for [2-(2-ethoxyethoxy)phenyl]-[3-(1H-imidazol-2-yl)piperidin-1-yl]methanone is CCOCCOc1ccccc1C(=O)N1CCCC(c2ncc[nH]2)C1.
What is the InChIKey of [2-(2-ethoxyethoxy)phenyl]-[3-(1H-imidazol-2-yl)piperidin-1-yl]methanone?
The InChIKey is JNRCJLIIQSDFRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O3/c1-2-24-12-13-25-17-8-4-3-7-16(17)19(23)22-11-5-6-15(14-22)18-20-9-10-21-18/h3-4,7-10,15H,2,5-6,11-14H2,1H3,(H,20,21).
What are the key properties of [2-(2-ethoxyethoxy)phenyl]-[3-(1H-imidazol-2-yl)piperidin-1-yl]methanone?
[2-(2-ethoxyethoxy)phenyl]-[3-(1H-imidazol-2-yl)piperidin-1-yl]methanone has a molecular weight of 343.43 g/mol, XLogP of 2.84, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-ethoxyethoxy)phenyl]-[3-(1H-imidazol-2-yl)piperidin-1-yl]methanone is sourced from PubChem (CID 70710484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).