1'-propylspiro[2,4-dihydro-1H-naphthalene-3,2'-piperidine];hydrochloride

C17H26ClN — CID 23361033

IUPAC1'-propylspiro[2,4-dihydro-1H-naphthalene-3,2'-piperidine];hydrochloride
SMILESCCCN1CCCCC12CCc1ccccc1C2.Cl
InChIInChI=1S/C17H25N.ClH/c1-2-12-18-13-6-5-10-17(18)11-9-15-7-3-4-8-16(15)14-17;/h3-4,7-8H,2,5-6,9-14H2,1H3;1H
InChIKeyTVWFBENYNLAUMW-UHFFFAOYSA-N
MW279.85 g/mol
LogP4.23
Rot. Bonds2

About 1'-propylspiro[2,4-dihydro-1H-naphthalene-3,2'-piperidine];hydrochloride

1'-propylspiro[2,4-dihydro-1H-naphthalene-3,2'-piperidine];hydrochloride (PubChem CID 23361033) has the molecular formula C17H26ClN and a molecular weight of 279.85 g/mol. Its IUPAC name is 1'-propylspiro[2,4-dihydro-1H-naphthalene-3,2'-piperidine];hydrochloride.

Molecular Properties

Compound Name1'-propylspiro[2,4-dihydro-1H-naphthalene-3,2'-piperidine];hydrochloride
PubChem CID23361033
Molecular FormulaC17H26ClN
Molecular Weight279.85 g/mol
Exact Mass279.18
IUPAC Name1'-propylspiro[2,4-dihydro-1H-naphthalene-3,2'-piperidine];hydrochloride
SMILESCCCN1CCCCC12CCc1ccccc1C2.Cl
InChIInChI=1S/C17H25N.ClH/c1-2-12-18-13-6-5-10-17(18)11-9-15-7-3-4-8-16(15)14-17;/h3-4,7-8H,2,5-6,9-14H2,1H3;1H
InChIKeyTVWFBENYNLAUMW-UHFFFAOYSA-N
XLogP4.23
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.85
LogP ≤ 54.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1'-propylspiro[2,4-dihydro-1H-naphthalene-3,2'-piperidine];hydrochloride?
The IUPAC name of 1'-propylspiro[2,4-dihydro-1H-naphthalene-3,2'-piperidine];hydrochloride (CID 23361033) is 1'-propylspiro[2,4-dihydro-1H-naphthalene-3,2'-piperidine];hydrochloride.
What is the SMILES notation for 1'-propylspiro[2,4-dihydro-1H-naphthalene-3,2'-piperidine];hydrochloride?
The canonical SMILES for 1'-propylspiro[2,4-dihydro-1H-naphthalene-3,2'-piperidine];hydrochloride is CCCN1CCCCC12CCc1ccccc1C2.Cl.
What is the InChIKey of 1'-propylspiro[2,4-dihydro-1H-naphthalene-3,2'-piperidine];hydrochloride?
The InChIKey is TVWFBENYNLAUMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N.ClH/c1-2-12-18-13-6-5-10-17(18)11-9-15-7-3-4-8-16(15)14-17;/h3-4,7-8H,2,5-6,9-14H2,1H3;1H.
What are the key properties of 1'-propylspiro[2,4-dihydro-1H-naphthalene-3,2'-piperidine];hydrochloride?
1'-propylspiro[2,4-dihydro-1H-naphthalene-3,2'-piperidine];hydrochloride has a molecular weight of 279.85 g/mol, XLogP of 4.23, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1'-propylspiro[2,4-dihydro-1H-naphthalene-3,2'-piperidine];hydrochloride is sourced from PubChem (CID 23361033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).