7-[(4-fluorophenyl)methoxy]spiro[2,4-dihydro-1H-naphthalene-3,2'-piperidine];hydrochloride

C21H25ClFNO — CID 23361058

IUPAC7-[(4-fluorophenyl)methoxy]spiro[2,4-dihydro-1H-naphthalene-3,2'-piperidine];hydrochloride
SMILESCl.Fc1ccc(COc2ccc3c(c2)CCC2(CCCCN2)C3)cc1
InChIInChI=1S/C21H24FNO.ClH/c22-19-6-3-16(4-7-19)15-24-20-8-5-18-14-21(10-1-2-12-23-21)11-9-17(18)13-20;/h3-8,13,23H,1-2,9-12,14-15H2;1H
InChIKeyUDOVASGVQWEAMH-UHFFFAOYSA-N
MW361.89 g/mol
LogP4.83
Rot. Bonds3

About 7-[(4-fluorophenyl)methoxy]spiro[2,4-dihydro-1H-naphthalene-3,2'-piperidine];hydrochloride

7-[(4-fluorophenyl)methoxy]spiro[2,4-dihydro-1H-naphthalene-3,2'-piperidine];hydrochloride (PubChem CID 23361058) has the molecular formula C21H25ClFNO and a molecular weight of 361.89 g/mol. Its IUPAC name is 7-[(4-fluorophenyl)methoxy]spiro[2,4-dihydro-1H-naphthalene-3,2'-piperidine];hydrochloride.

Molecular Properties

Compound Name7-[(4-fluorophenyl)methoxy]spiro[2,4-dihydro-1H-naphthalene-3,2'-piperidine];hydrochloride
PubChem CID23361058
Molecular FormulaC21H25ClFNO
Molecular Weight361.89 g/mol
Exact Mass361.16
IUPAC Name7-[(4-fluorophenyl)methoxy]spiro[2,4-dihydro-1H-naphthalene-3,2'-piperidine];hydrochloride
SMILESCl.Fc1ccc(COc2ccc3c(c2)CCC2(CCCCN2)C3)cc1
InChIInChI=1S/C21H24FNO.ClH/c22-19-6-3-16(4-7-19)15-24-20-8-5-18-14-21(10-1-2-12-23-21)11-9-17(18)13-20;/h3-8,13,23H,1-2,9-12,14-15H2;1H
InChIKeyUDOVASGVQWEAMH-UHFFFAOYSA-N
XLogP4.83
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.89
LogP ≤ 54.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-[(4-fluorophenyl)methoxy]spiro[2,4-dihydro-1H-naphthalene-3,2'-piperidine];hydrochloride?
The IUPAC name of 7-[(4-fluorophenyl)methoxy]spiro[2,4-dihydro-1H-naphthalene-3,2'-piperidine];hydrochloride (CID 23361058) is 7-[(4-fluorophenyl)methoxy]spiro[2,4-dihydro-1H-naphthalene-3,2'-piperidine];hydrochloride.
What is the SMILES notation for 7-[(4-fluorophenyl)methoxy]spiro[2,4-dihydro-1H-naphthalene-3,2'-piperidine];hydrochloride?
The canonical SMILES for 7-[(4-fluorophenyl)methoxy]spiro[2,4-dihydro-1H-naphthalene-3,2'-piperidine];hydrochloride is Cl.Fc1ccc(COc2ccc3c(c2)CCC2(CCCCN2)C3)cc1.
What is the InChIKey of 7-[(4-fluorophenyl)methoxy]spiro[2,4-dihydro-1H-naphthalene-3,2'-piperidine];hydrochloride?
The InChIKey is UDOVASGVQWEAMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24FNO.ClH/c22-19-6-3-16(4-7-19)15-24-20-8-5-18-14-21(10-1-2-12-23-21)11-9-17(18)13-20;/h3-8,13,23H,1-2,9-12,14-15H2;1H.
What are the key properties of 7-[(4-fluorophenyl)methoxy]spiro[2,4-dihydro-1H-naphthalene-3,2'-piperidine];hydrochloride?
7-[(4-fluorophenyl)methoxy]spiro[2,4-dihydro-1H-naphthalene-3,2'-piperidine];hydrochloride has a molecular weight of 361.89 g/mol, XLogP of 4.83, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[(4-fluorophenyl)methoxy]spiro[2,4-dihydro-1H-naphthalene-3,2'-piperidine];hydrochloride is sourced from PubChem (CID 23361058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).