4-[4-(1H-imidazol-2-yl)piperidin-1-yl]-2,6-dimethylpyridine

C15H20N4 — CID 70718693

IUPAC4-[4-(1H-imidazol-2-yl)piperidin-1-yl]-2,6-dimethylpyridine
SMILESCc1cc(N2CCC(c3ncc[nH]3)CC2)cc(C)n1
InChIInChI=1S/C15H20N4/c1-11-9-14(10-12(2)18-11)19-7-3-13(4-8-19)15-16-5-6-17-15/h5-6,9-10,13H,3-4,7-8H2,1-2H3,(H,16,17)
InChIKeyXECRVGABDCFJCX-UHFFFAOYSA-N
MW256.35 g/mol
LogP2.81
Rot. Bonds2

About 4-[4-(1H-imidazol-2-yl)piperidin-1-yl]-2,6-dimethylpyridine

4-[4-(1H-imidazol-2-yl)piperidin-1-yl]-2,6-dimethylpyridine (PubChem CID 70718693) has the molecular formula C15H20N4 and a molecular weight of 256.35 g/mol. Its IUPAC name is 4-[4-(1H-imidazol-2-yl)piperidin-1-yl]-2,6-dimethylpyridine.

Molecular Properties

Compound Name4-[4-(1H-imidazol-2-yl)piperidin-1-yl]-2,6-dimethylpyridine
PubChem CID70718693
Molecular FormulaC15H20N4
Molecular Weight256.35 g/mol
Exact Mass256.17
IUPAC Name4-[4-(1H-imidazol-2-yl)piperidin-1-yl]-2,6-dimethylpyridine
SMILESCc1cc(N2CCC(c3ncc[nH]3)CC2)cc(C)n1
InChIInChI=1S/C15H20N4/c1-11-9-14(10-12(2)18-11)19-7-3-13(4-8-19)15-16-5-6-17-15/h5-6,9-10,13H,3-4,7-8H2,1-2H3,(H,16,17)
InChIKeyXECRVGABDCFJCX-UHFFFAOYSA-N
XLogP2.81
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[4-(1H-imidazol-2-yl)piperidin-1-yl]-2,6-dimethylpyridine?
The IUPAC name of 4-[4-(1H-imidazol-2-yl)piperidin-1-yl]-2,6-dimethylpyridine (CID 70718693) is 4-[4-(1H-imidazol-2-yl)piperidin-1-yl]-2,6-dimethylpyridine.
What is the SMILES notation for 4-[4-(1H-imidazol-2-yl)piperidin-1-yl]-2,6-dimethylpyridine?
The canonical SMILES for 4-[4-(1H-imidazol-2-yl)piperidin-1-yl]-2,6-dimethylpyridine is Cc1cc(N2CCC(c3ncc[nH]3)CC2)cc(C)n1.
What is the InChIKey of 4-[4-(1H-imidazol-2-yl)piperidin-1-yl]-2,6-dimethylpyridine?
The InChIKey is XECRVGABDCFJCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4/c1-11-9-14(10-12(2)18-11)19-7-3-13(4-8-19)15-16-5-6-17-15/h5-6,9-10,13H,3-4,7-8H2,1-2H3,(H,16,17).
What are the key properties of 4-[4-(1H-imidazol-2-yl)piperidin-1-yl]-2,6-dimethylpyridine?
4-[4-(1H-imidazol-2-yl)piperidin-1-yl]-2,6-dimethylpyridine has a molecular weight of 256.35 g/mol, XLogP of 2.81, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(1H-imidazol-2-yl)piperidin-1-yl]-2,6-dimethylpyridine is sourced from PubChem (CID 70718693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).