1-[1-(5-methylfuran-2-yl)cyclohexyl]piperidine

C16H25NO — CID 97355679

IUPAC1-[1-(5-methylfuran-2-yl)cyclohexyl]piperidine
SMILESCc1ccc(C2(N3CCCCC3)CCCCC2)o1
InChIInChI=1S/C16H25NO/c1-14-8-9-15(18-14)16(10-4-2-5-11-16)17-12-6-3-7-13-17/h8-9H,2-7,10-13H2,1H3
InChIKeyLDZQFSONEOPMLA-UHFFFAOYSA-N
MW247.38 g/mol
LogP4.23
Rot. Bonds2

About 1-[1-(5-methylfuran-2-yl)cyclohexyl]piperidine

1-[1-(5-methylfuran-2-yl)cyclohexyl]piperidine (PubChem CID 97355679) has the molecular formula C16H25NO and a molecular weight of 247.38 g/mol. Its IUPAC name is 1-[1-(5-methylfuran-2-yl)cyclohexyl]piperidine.

Molecular Properties

Compound Name1-[1-(5-methylfuran-2-yl)cyclohexyl]piperidine
PubChem CID97355679
Molecular FormulaC16H25NO
Molecular Weight247.38 g/mol
Exact Mass247.19
IUPAC Name1-[1-(5-methylfuran-2-yl)cyclohexyl]piperidine
SMILESCc1ccc(C2(N3CCCCC3)CCCCC2)o1
InChIInChI=1S/C16H25NO/c1-14-8-9-15(18-14)16(10-4-2-5-11-16)17-12-6-3-7-13-17/h8-9H,2-7,10-13H2,1H3
InChIKeyLDZQFSONEOPMLA-UHFFFAOYSA-N
XLogP4.23
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.38
LogP ≤ 54.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[1-(5-methylfuran-2-yl)cyclohexyl]piperidine?
The IUPAC name of 1-[1-(5-methylfuran-2-yl)cyclohexyl]piperidine (CID 97355679) is 1-[1-(5-methylfuran-2-yl)cyclohexyl]piperidine.
What is the SMILES notation for 1-[1-(5-methylfuran-2-yl)cyclohexyl]piperidine?
The canonical SMILES for 1-[1-(5-methylfuran-2-yl)cyclohexyl]piperidine is Cc1ccc(C2(N3CCCCC3)CCCCC2)o1.
What is the InChIKey of 1-[1-(5-methylfuran-2-yl)cyclohexyl]piperidine?
The InChIKey is LDZQFSONEOPMLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO/c1-14-8-9-15(18-14)16(10-4-2-5-11-16)17-12-6-3-7-13-17/h8-9H,2-7,10-13H2,1H3.
What are the key properties of 1-[1-(5-methylfuran-2-yl)cyclohexyl]piperidine?
1-[1-(5-methylfuran-2-yl)cyclohexyl]piperidine has a molecular weight of 247.38 g/mol, XLogP of 4.23, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(5-methylfuran-2-yl)cyclohexyl]piperidine is sourced from PubChem (CID 97355679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).