4-(difluoromethyl)-2-[3-(1H-imidazol-2-yl)piperidin-1-yl]pyridine

C14H16F2N4 — CID 166270987

IUPAC4-(difluoromethyl)-2-[3-(1H-imidazol-2-yl)piperidin-1-yl]pyridine
SMILESFC(F)c1ccnc(N2CCCC(c3ncc[nH]3)C2)c1
InChIInChI=1S/C14H16F2N4/c15-13(16)10-3-4-17-12(8-10)20-7-1-2-11(9-20)14-18-5-6-19-14/h3-6,8,11,13H,1-2,7,9H2,(H,18,19)
InChIKeyPPVMZXNFUBCRKU-UHFFFAOYSA-N
MW278.31 g/mol
LogP3.13
Rot. Bonds3

About 4-(difluoromethyl)-2-[3-(1H-imidazol-2-yl)piperidin-1-yl]pyridine

4-(difluoromethyl)-2-[3-(1H-imidazol-2-yl)piperidin-1-yl]pyridine (PubChem CID 166270987) has the molecular formula C14H16F2N4 and a molecular weight of 278.31 g/mol. Its IUPAC name is 4-(difluoromethyl)-2-[3-(1H-imidazol-2-yl)piperidin-1-yl]pyridine.

Molecular Properties

Compound Name4-(difluoromethyl)-2-[3-(1H-imidazol-2-yl)piperidin-1-yl]pyridine
PubChem CID166270987
Molecular FormulaC14H16F2N4
Molecular Weight278.31 g/mol
Exact Mass278.13
IUPAC Name4-(difluoromethyl)-2-[3-(1H-imidazol-2-yl)piperidin-1-yl]pyridine
SMILESFC(F)c1ccnc(N2CCCC(c3ncc[nH]3)C2)c1
InChIInChI=1S/C14H16F2N4/c15-13(16)10-3-4-17-12(8-10)20-7-1-2-11(9-20)14-18-5-6-19-14/h3-6,8,11,13H,1-2,7,9H2,(H,18,19)
InChIKeyPPVMZXNFUBCRKU-UHFFFAOYSA-N
XLogP3.13
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(difluoromethyl)-2-[3-(1H-imidazol-2-yl)piperidin-1-yl]pyridine?
The IUPAC name of 4-(difluoromethyl)-2-[3-(1H-imidazol-2-yl)piperidin-1-yl]pyridine (CID 166270987) is 4-(difluoromethyl)-2-[3-(1H-imidazol-2-yl)piperidin-1-yl]pyridine.
What is the SMILES notation for 4-(difluoromethyl)-2-[3-(1H-imidazol-2-yl)piperidin-1-yl]pyridine?
The canonical SMILES for 4-(difluoromethyl)-2-[3-(1H-imidazol-2-yl)piperidin-1-yl]pyridine is FC(F)c1ccnc(N2CCCC(c3ncc[nH]3)C2)c1.
What is the InChIKey of 4-(difluoromethyl)-2-[3-(1H-imidazol-2-yl)piperidin-1-yl]pyridine?
The InChIKey is PPVMZXNFUBCRKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16F2N4/c15-13(16)10-3-4-17-12(8-10)20-7-1-2-11(9-20)14-18-5-6-19-14/h3-6,8,11,13H,1-2,7,9H2,(H,18,19).
What are the key properties of 4-(difluoromethyl)-2-[3-(1H-imidazol-2-yl)piperidin-1-yl]pyridine?
4-(difluoromethyl)-2-[3-(1H-imidazol-2-yl)piperidin-1-yl]pyridine has a molecular weight of 278.31 g/mol, XLogP of 3.13, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(difluoromethyl)-2-[3-(1H-imidazol-2-yl)piperidin-1-yl]pyridine is sourced from PubChem (CID 166270987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).