4-methyl-4-(3-methylimidazol-4-yl)piperidine

C10H17N3 — CID 114717460

IUPAC4-methyl-4-(3-methylimidazol-4-yl)piperidine
SMILESCn1cncc1C1(C)CCNCC1
InChIInChI=1S/C10H17N3/c1-10(3-5-11-6-4-10)9-7-12-8-13(9)2/h7-8,11H,3-6H2,1-2H3
InChIKeyQPUKGRFQPFOABR-UHFFFAOYSA-N
MW179.27 g/mol
LogP1.06
Rot. Bonds1

About 4-methyl-4-(3-methylimidazol-4-yl)piperidine

4-methyl-4-(3-methylimidazol-4-yl)piperidine (PubChem CID 114717460) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is 4-methyl-4-(3-methylimidazol-4-yl)piperidine.

Molecular Properties

Compound Name4-methyl-4-(3-methylimidazol-4-yl)piperidine
PubChem CID114717460
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC Name4-methyl-4-(3-methylimidazol-4-yl)piperidine
SMILESCn1cncc1C1(C)CCNCC1
InChIInChI=1S/C10H17N3/c1-10(3-5-11-6-4-10)9-7-12-8-13(9)2/h7-8,11H,3-6H2,1-2H3
InChIKeyQPUKGRFQPFOABR-UHFFFAOYSA-N
XLogP1.06
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-methyl-4-[3-(4-methylphenyl)imidazol-4-yl]piperidine
CID 114717532
4-methyl-4-[3-(3-methyl-2-propan-2-ylbutyl)imidazol-4-yl]piperidine
CID 102909131
4-methyl-4-[3-[(1-methylpyrazol-3-yl)methyl]imidazol-4-yl]piperidine
CID 114721609
4-methyl-4-[3-(3-methylsulfonylpropyl)imidazol-4-yl]piperidine
CID 114718584
4-methyl-4-[3-(2-methylcyclohexyl)imidazol-4-yl]piperidine
CID 114717091
4-(3-benzylimidazol-4-yl)-4-methylpiperidine
CID 114716257
4-[3-(2-bromo-3-methylphenyl)imidazol-4-yl]-4-methylpiperidine
CID 114721544
4-[3-(4-imidazol-1-ylbutyl)imidazol-4-yl]-4-methylpiperidine
CID 114718896
ethyl 3-[5-(4-methylpiperidin-4-yl)imidazol-1-yl]propanoate
CID 114719023
4-[3-[2-(furan-2-yl)ethyl]imidazol-4-yl]-4-methylpiperidine
CID 114718688
4-methyl-4-[3-(thian-4-ylmethyl)imidazol-4-yl]piperidine
CID 114722157
N,N-diethyl-2-[5-(4-methylpiperidin-4-yl)imidazol-1-yl]acetamide
CID 114721954

Frequently Asked Questions

What is the IUPAC name of 4-methyl-4-(3-methylimidazol-4-yl)piperidine?
The IUPAC name of 4-methyl-4-(3-methylimidazol-4-yl)piperidine (CID 114717460) is 4-methyl-4-(3-methylimidazol-4-yl)piperidine.
What is the SMILES notation for 4-methyl-4-(3-methylimidazol-4-yl)piperidine?
The canonical SMILES for 4-methyl-4-(3-methylimidazol-4-yl)piperidine is Cn1cncc1C1(C)CCNCC1.
What is the InChIKey of 4-methyl-4-(3-methylimidazol-4-yl)piperidine?
The InChIKey is QPUKGRFQPFOABR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-10(3-5-11-6-4-10)9-7-12-8-13(9)2/h7-8,11H,3-6H2,1-2H3.
What are the key properties of 4-methyl-4-(3-methylimidazol-4-yl)piperidine?
4-methyl-4-(3-methylimidazol-4-yl)piperidine has a molecular weight of 179.27 g/mol, XLogP of 1.06, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-4-(3-methylimidazol-4-yl)piperidine is sourced from PubChem (CID 114717460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).