4-methyl-4-[3-[(1-methylpyrazol-3-yl)methyl]imidazol-4-yl]piperidine

C14H21N5 — CID 114721609

IUPAC4-methyl-4-[3-[(1-methylpyrazol-3-yl)methyl]imidazol-4-yl]piperidine
SMILESCn1ccc(Cn2cncc2C2(C)CCNCC2)n1
InChIInChI=1S/C14H21N5/c1-14(4-6-15-7-5-14)13-9-16-11-19(13)10-12-3-8-18(2)17-12/h3,8-9,11,15H,4-7,10H2,1-2H3
InChIKeyMJYDBRDLIOKZTF-UHFFFAOYSA-N
MW259.36 g/mol
LogP1.31
Rot. Bonds3

About 4-methyl-4-[3-[(1-methylpyrazol-3-yl)methyl]imidazol-4-yl]piperidine

4-methyl-4-[3-[(1-methylpyrazol-3-yl)methyl]imidazol-4-yl]piperidine (PubChem CID 114721609) has the molecular formula C14H21N5 and a molecular weight of 259.36 g/mol. Its IUPAC name is 4-methyl-4-[3-[(1-methylpyrazol-3-yl)methyl]imidazol-4-yl]piperidine.

Molecular Properties

Compound Name4-methyl-4-[3-[(1-methylpyrazol-3-yl)methyl]imidazol-4-yl]piperidine
PubChem CID114721609
Molecular FormulaC14H21N5
Molecular Weight259.36 g/mol
Exact Mass259.18
IUPAC Name4-methyl-4-[3-[(1-methylpyrazol-3-yl)methyl]imidazol-4-yl]piperidine
SMILESCn1ccc(Cn2cncc2C2(C)CCNCC2)n1
InChIInChI=1S/C14H21N5/c1-14(4-6-15-7-5-14)13-9-16-11-19(13)10-12-3-8-18(2)17-12/h3,8-9,11,15H,4-7,10H2,1-2H3
InChIKeyMJYDBRDLIOKZTF-UHFFFAOYSA-N
XLogP1.31
TPSA47.67 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.36
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(3-benzylimidazol-4-yl)-4-methylpiperidine
CID 114716257
4-methyl-4-(3-methylimidazol-4-yl)piperidine
CID 114717460
4-[3-[(3-fluorophenyl)methyl]imidazol-4-yl]-4-methylpiperidine
CID 114717839
4-[3-[2-(furan-2-yl)ethyl]imidazol-4-yl]-4-methylpiperidine
CID 114718688
5-methyl-3-[[5-(4-methylpiperidin-4-yl)imidazol-1-yl]methyl]-1,2,4-oxadiazole
CID 106410304
4-[3-(4-imidazol-1-ylbutyl)imidazol-4-yl]-4-methylpiperidine
CID 114718896
4-methyl-4-[3-(3-methyl-2-propan-2-ylbutyl)imidazol-4-yl]piperidine
CID 102909131
4-methyl-4-[3-(3-methylsulfonylpropyl)imidazol-4-yl]piperidine
CID 114718584
1,3-dimethyl-4-[[5-(3-methylpyrrolidin-3-yl)imidazol-1-yl]methyl]pyrazole
CID 114721843
ethyl 3-[5-(4-methylpiperidin-4-yl)imidazol-1-yl]propanoate
CID 114719023
N,N-diethyl-2-[5-(4-methylpiperidin-4-yl)imidazol-1-yl]acetamide
CID 114721954
2,2-dimethyl-3-[5-(4-methylpiperidin-4-yl)imidazol-1-yl]propanamide
CID 106278172

Frequently Asked Questions

What is the IUPAC name of 4-methyl-4-[3-[(1-methylpyrazol-3-yl)methyl]imidazol-4-yl]piperidine?
The IUPAC name of 4-methyl-4-[3-[(1-methylpyrazol-3-yl)methyl]imidazol-4-yl]piperidine (CID 114721609) is 4-methyl-4-[3-[(1-methylpyrazol-3-yl)methyl]imidazol-4-yl]piperidine.
What is the SMILES notation for 4-methyl-4-[3-[(1-methylpyrazol-3-yl)methyl]imidazol-4-yl]piperidine?
The canonical SMILES for 4-methyl-4-[3-[(1-methylpyrazol-3-yl)methyl]imidazol-4-yl]piperidine is Cn1ccc(Cn2cncc2C2(C)CCNCC2)n1.
What is the InChIKey of 4-methyl-4-[3-[(1-methylpyrazol-3-yl)methyl]imidazol-4-yl]piperidine?
The InChIKey is MJYDBRDLIOKZTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5/c1-14(4-6-15-7-5-14)13-9-16-11-19(13)10-12-3-8-18(2)17-12/h3,8-9,11,15H,4-7,10H2,1-2H3.
What are the key properties of 4-methyl-4-[3-[(1-methylpyrazol-3-yl)methyl]imidazol-4-yl]piperidine?
4-methyl-4-[3-[(1-methylpyrazol-3-yl)methyl]imidazol-4-yl]piperidine has a molecular weight of 259.36 g/mol, XLogP of 1.31, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-4-[3-[(1-methylpyrazol-3-yl)methyl]imidazol-4-yl]piperidine is sourced from PubChem (CID 114721609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).