4-(fluoromethyl)-1-(1H-imidazol-5-ylmethyl)piperidine

C10H16FN3 — CID 154760047

IUPAC4-(fluoromethyl)-1-(1H-imidazol-5-ylmethyl)piperidine
SMILESFCC1CCN(Cc2cnc[nH]2)CC1
InChIInChI=1S/C10H16FN3/c11-5-9-1-3-14(4-2-9)7-10-6-12-8-13-10/h6,8-9H,1-5,7H2,(H,12,13)
InChIKeyRZDBGVOKHOIQHP-UHFFFAOYSA-N
MW197.26 g/mol
LogP1.59
Rot. Bonds3

About 4-(fluoromethyl)-1-(1H-imidazol-5-ylmethyl)piperidine

4-(fluoromethyl)-1-(1H-imidazol-5-ylmethyl)piperidine (PubChem CID 154760047) has the molecular formula C10H16FN3 and a molecular weight of 197.26 g/mol. Its IUPAC name is 4-(fluoromethyl)-1-(1H-imidazol-5-ylmethyl)piperidine.

Molecular Properties

Compound Name4-(fluoromethyl)-1-(1H-imidazol-5-ylmethyl)piperidine
PubChem CID154760047
Molecular FormulaC10H16FN3
Molecular Weight197.26 g/mol
Exact Mass197.13
IUPAC Name4-(fluoromethyl)-1-(1H-imidazol-5-ylmethyl)piperidine
SMILESFCC1CCN(Cc2cnc[nH]2)CC1
InChIInChI=1S/C10H16FN3/c11-5-9-1-3-14(4-2-9)7-10-6-12-8-13-10/h6,8-9H,1-5,7H2,(H,12,13)
InChIKeyRZDBGVOKHOIQHP-UHFFFAOYSA-N
XLogP1.59
TPSA31.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.26
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(fluoromethyl)-1-(1H-imidazol-5-ylmethyl)piperidine?
The IUPAC name of 4-(fluoromethyl)-1-(1H-imidazol-5-ylmethyl)piperidine (CID 154760047) is 4-(fluoromethyl)-1-(1H-imidazol-5-ylmethyl)piperidine.
What is the SMILES notation for 4-(fluoromethyl)-1-(1H-imidazol-5-ylmethyl)piperidine?
The canonical SMILES for 4-(fluoromethyl)-1-(1H-imidazol-5-ylmethyl)piperidine is FCC1CCN(Cc2cnc[nH]2)CC1.
What is the InChIKey of 4-(fluoromethyl)-1-(1H-imidazol-5-ylmethyl)piperidine?
The InChIKey is RZDBGVOKHOIQHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16FN3/c11-5-9-1-3-14(4-2-9)7-10-6-12-8-13-10/h6,8-9H,1-5,7H2,(H,12,13).
What are the key properties of 4-(fluoromethyl)-1-(1H-imidazol-5-ylmethyl)piperidine?
4-(fluoromethyl)-1-(1H-imidazol-5-ylmethyl)piperidine has a molecular weight of 197.26 g/mol, XLogP of 1.59, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(fluoromethyl)-1-(1H-imidazol-5-ylmethyl)piperidine is sourced from PubChem (CID 154760047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).