4-[2-[(2-propyl-1H-imidazol-5-yl)methoxy]ethyl]piperidine

C14H25N3O — CID 91421736

IUPAC4-[2-[(2-propyl-1H-imidazol-5-yl)methoxy]ethyl]piperidine
SMILESCCCc1ncc(COCCC2CCNCC2)[nH]1
InChIInChI=1S/C14H25N3O/c1-2-3-14-16-10-13(17-14)11-18-9-6-12-4-7-15-8-5-12/h10,12,15H,2-9,11H2,1H3,(H,16,17)
InChIKeyKNKIBNJBZSUEAJ-UHFFFAOYSA-N
MW251.37 g/mol
LogP2.27
Rot. Bonds7

About 4-[2-[(2-propyl-1H-imidazol-5-yl)methoxy]ethyl]piperidine

4-[2-[(2-propyl-1H-imidazol-5-yl)methoxy]ethyl]piperidine (PubChem CID 91421736) has the molecular formula C14H25N3O and a molecular weight of 251.37 g/mol. Its IUPAC name is 4-[2-[(2-propyl-1H-imidazol-5-yl)methoxy]ethyl]piperidine.

Molecular Properties

Compound Name4-[2-[(2-propyl-1H-imidazol-5-yl)methoxy]ethyl]piperidine
PubChem CID91421736
Molecular FormulaC14H25N3O
Molecular Weight251.37 g/mol
Exact Mass251.20
IUPAC Name4-[2-[(2-propyl-1H-imidazol-5-yl)methoxy]ethyl]piperidine
SMILESCCCc1ncc(COCCC2CCNCC2)[nH]1
InChIInChI=1S/C14H25N3O/c1-2-3-14-16-10-13(17-14)11-18-9-6-12-4-7-15-8-5-12/h10,12,15H,2-9,11H2,1H3,(H,16,17)
InChIKeyKNKIBNJBZSUEAJ-UHFFFAOYSA-N
XLogP2.27
TPSA49.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 4-[2-[(2-propyl-1H-imidazol-5-yl)methoxy]ethyl]piperidine 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

Cyclohexylmethyl (1H-imidazol-4-yl)methyl ether
CID 11264034
5-(3-cyclohexylpropoxymethyl)-1H-imidazole
CID 11356502
5-(2-cyclohexylethoxymethyl)-1H-imidazole
CID 11816608
4-{[4-(methoxymethyl)-1H-1,2,3-triazol-1-yl]methyl}-1-[(4-methyl-1H-imidazol-2-yl)methyl]piperidine bis(trifluoroacetate)
CID 29086119
Ethoxymethyl-2-methylimidazole
CID 117191588
ethyl 2-(piperidin-4-yl)-1H-imidazole-4-carboxylate
CID 19029128
5-(butoxymethyl)-1H-imidazole
CID 21401482
1-cyano-3-[3-(1H-imidazol-5-ylmethoxy)propyl]-2-methylguanidine
CID 54031284
2-n-Butyl-1-(trimethylsilyl)ethoxymethylimidazole
CID 54439725
(2-butyl-1H-imidazol-5-yl)methyl acetate
CID 57154458
5-Methyl-2-(tetrahydro-2H-pyran-4-yl)-1H-imidazole
CID 58575068
5-(methoxymethyl)-2-methyl-1H-imidazole
CID 59256870

Frequently Asked Questions

What is the IUPAC name of 4-[2-[(2-propyl-1H-imidazol-5-yl)methoxy]ethyl]piperidine?
The IUPAC name of 4-[2-[(2-propyl-1H-imidazol-5-yl)methoxy]ethyl]piperidine (CID 91421736) is 4-[2-[(2-propyl-1H-imidazol-5-yl)methoxy]ethyl]piperidine.
What is the SMILES notation for 4-[2-[(2-propyl-1H-imidazol-5-yl)methoxy]ethyl]piperidine?
The canonical SMILES for 4-[2-[(2-propyl-1H-imidazol-5-yl)methoxy]ethyl]piperidine is CCCc1ncc(COCCC2CCNCC2)[nH]1.
What is the InChIKey of 4-[2-[(2-propyl-1H-imidazol-5-yl)methoxy]ethyl]piperidine?
The InChIKey is KNKIBNJBZSUEAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O/c1-2-3-14-16-10-13(17-14)11-18-9-6-12-4-7-15-8-5-12/h10,12,15H,2-9,11H2,1H3,(H,16,17).
What are the key properties of 4-[2-[(2-propyl-1H-imidazol-5-yl)methoxy]ethyl]piperidine?
4-[2-[(2-propyl-1H-imidazol-5-yl)methoxy]ethyl]piperidine has a molecular weight of 251.37 g/mol, XLogP of 2.27, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[(2-propyl-1H-imidazol-5-yl)methoxy]ethyl]piperidine is sourced from PubChem (CID 91421736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).