4-[(3-propylimidazol-4-yl)methoxy]piperidine

C12H21N3O — CID 106937644

IUPAC4-[(3-propylimidazol-4-yl)methoxy]piperidine
SMILESCCCn1cncc1COC1CCNCC1
InChIInChI=1S/C12H21N3O/c1-2-7-15-10-14-8-11(15)9-16-12-3-5-13-6-4-12/h8,10,12-13H,2-7,9H2,1H3
InChIKeyXFNFREINESJBHS-UHFFFAOYSA-N
MW223.32 g/mol
LogP1.56
Rot. Bonds5

About 4-[(3-propylimidazol-4-yl)methoxy]piperidine

4-[(3-propylimidazol-4-yl)methoxy]piperidine (PubChem CID 106937644) has the molecular formula C12H21N3O and a molecular weight of 223.32 g/mol. Its IUPAC name is 4-[(3-propylimidazol-4-yl)methoxy]piperidine.

Molecular Properties

Compound Name4-[(3-propylimidazol-4-yl)methoxy]piperidine
PubChem CID106937644
Molecular FormulaC12H21N3O
Molecular Weight223.32 g/mol
Exact Mass223.17
IUPAC Name4-[(3-propylimidazol-4-yl)methoxy]piperidine
SMILESCCCn1cncc1COC1CCNCC1
InChIInChI=1S/C12H21N3O/c1-2-7-15-10-14-8-11(15)9-16-12-3-5-13-6-4-12/h8,10,12-13H,2-7,9H2,1H3
InChIKeyXFNFREINESJBHS-UHFFFAOYSA-N
XLogP1.56
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(3-ethylimidazol-4-yl)methyl]piperidine
CID 84665127
3-[(3-propylimidazol-4-yl)methoxy]propan-1-amine
CID 106938080
4-[(4-ethyl-1,2,4-triazol-3-yl)methoxy]piperidine
CID 63875830
3-methyl-1-[(3-propylimidazol-4-yl)methyl]piperazine
CID 66130031
5-(2,2-dimethylpyrrolidin-3-yl)-1-propylimidazole
CID 66130852
N-[(3-ethylimidazol-4-yl)methyl]-N-(piperidin-4-ylmethyl)cyclopropanamine
CID 79715367
1-[4-[(3-propylimidazol-4-yl)methoxy]phenyl]propan-1-amine
CID 66153014
1-propyl-N-[(3-propylimidazol-4-yl)methyl]piperidin-4-amine
CID 66134778
4-[5-(2-methylpropyl)imidazol-1-yl]azepane
CID 107174388
[2-[(3-propylimidazol-4-yl)methylamino]cyclopentyl]methanol
CID 114178487
N-methyl-1-[4-[(3-propylimidazol-4-yl)methoxy]phenyl]methanamine
CID 66154174
4-propyl-N-[(3-propylimidazol-4-yl)methyl]cyclohexan-1-amine
CID 66129378

Frequently Asked Questions

What is the IUPAC name of 4-[(3-propylimidazol-4-yl)methoxy]piperidine?
The IUPAC name of 4-[(3-propylimidazol-4-yl)methoxy]piperidine (CID 106937644) is 4-[(3-propylimidazol-4-yl)methoxy]piperidine.
What is the SMILES notation for 4-[(3-propylimidazol-4-yl)methoxy]piperidine?
The canonical SMILES for 4-[(3-propylimidazol-4-yl)methoxy]piperidine is CCCn1cncc1COC1CCNCC1.
What is the InChIKey of 4-[(3-propylimidazol-4-yl)methoxy]piperidine?
The InChIKey is XFNFREINESJBHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O/c1-2-7-15-10-14-8-11(15)9-16-12-3-5-13-6-4-12/h8,10,12-13H,2-7,9H2,1H3.
What are the key properties of 4-[(3-propylimidazol-4-yl)methoxy]piperidine?
4-[(3-propylimidazol-4-yl)methoxy]piperidine has a molecular weight of 223.32 g/mol, XLogP of 1.56, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3-propylimidazol-4-yl)methoxy]piperidine is sourced from PubChem (CID 106937644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).