1-(9H-fluoren-9-yl)-4-(2-methylpropoxy)piperidine

C22H27NO — CID 55864925

IUPAC1-(9H-fluoren-9-yl)-4-(2-methylpropoxy)piperidine
SMILESCC(C)COC1CCN(C2c3ccccc3-c3ccccc32)CC1
InChIInChI=1S/C22H27NO/c1-16(2)15-24-17-11-13-23(14-12-17)22-20-9-5-3-7-18(20)19-8-4-6-10-21(19)22/h3-10,16-17,22H,11-15H2,1-2H3
InChIKeyDQHLNZPGHCGBFW-UHFFFAOYSA-N
MW321.46 g/mol
LogP4.89
Rot. Bonds4

About 1-(9H-fluoren-9-yl)-4-(2-methylpropoxy)piperidine

1-(9H-fluoren-9-yl)-4-(2-methylpropoxy)piperidine (PubChem CID 55864925) has the molecular formula C22H27NO and a molecular weight of 321.46 g/mol. Its IUPAC name is 1-(9H-fluoren-9-yl)-4-(2-methylpropoxy)piperidine.

Molecular Properties

Compound Name1-(9H-fluoren-9-yl)-4-(2-methylpropoxy)piperidine
PubChem CID55864925
Molecular FormulaC22H27NO
Molecular Weight321.46 g/mol
Exact Mass321.21
IUPAC Name1-(9H-fluoren-9-yl)-4-(2-methylpropoxy)piperidine
SMILESCC(C)COC1CCN(C2c3ccccc3-c3ccccc32)CC1
InChIInChI=1S/C22H27NO/c1-16(2)15-24-17-11-13-23(14-12-17)22-20-9-5-3-7-18(20)19-8-4-6-10-21(19)22/h3-10,16-17,22H,11-15H2,1-2H3
InChIKeyDQHLNZPGHCGBFW-UHFFFAOYSA-N
XLogP4.89
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.46
LogP ≤ 54.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(9H-fluoren-9-yl)-4-(2-methylpropoxy)piperidine?
The IUPAC name of 1-(9H-fluoren-9-yl)-4-(2-methylpropoxy)piperidine (CID 55864925) is 1-(9H-fluoren-9-yl)-4-(2-methylpropoxy)piperidine.
What is the SMILES notation for 1-(9H-fluoren-9-yl)-4-(2-methylpropoxy)piperidine?
The canonical SMILES for 1-(9H-fluoren-9-yl)-4-(2-methylpropoxy)piperidine is CC(C)COC1CCN(C2c3ccccc3-c3ccccc32)CC1.
What is the InChIKey of 1-(9H-fluoren-9-yl)-4-(2-methylpropoxy)piperidine?
The InChIKey is DQHLNZPGHCGBFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27NO/c1-16(2)15-24-17-11-13-23(14-12-17)22-20-9-5-3-7-18(20)19-8-4-6-10-21(19)22/h3-10,16-17,22H,11-15H2,1-2H3.
What are the key properties of 1-(9H-fluoren-9-yl)-4-(2-methylpropoxy)piperidine?
1-(9H-fluoren-9-yl)-4-(2-methylpropoxy)piperidine has a molecular weight of 321.46 g/mol, XLogP of 4.89, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(9H-fluoren-9-yl)-4-(2-methylpropoxy)piperidine is sourced from PubChem (CID 55864925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).