1-[3-(6-methoxynaphthalen-1-yl)propyl]piperidine;hydrochloride

C19H26ClNO — CID 11645434

IUPAC1-[3-(6-methoxynaphthalen-1-yl)propyl]piperidine;hydrochloride
SMILESCOc1ccc2c(CCCN3CCCCC3)cccc2c1.Cl
InChIInChI=1S/C19H25NO.ClH/c1-21-18-10-11-19-16(7-5-8-17(19)15-18)9-6-14-20-12-3-2-4-13-20;/h5,7-8,10-11,15H,2-4,6,9,12-14H2,1H3;1H
InChIKeyMCFPYFNQAUCIQW-UHFFFAOYSA-N
MW319.88 g/mol
LogP4.69
Rot. Bonds5

About 1-[3-(6-methoxynaphthalen-1-yl)propyl]piperidine;hydrochloride

1-[3-(6-methoxynaphthalen-1-yl)propyl]piperidine;hydrochloride (PubChem CID 11645434) has the molecular formula C19H26ClNO and a molecular weight of 319.88 g/mol. Its IUPAC name is 1-[3-(6-methoxynaphthalen-1-yl)propyl]piperidine;hydrochloride.

Molecular Properties

Compound Name1-[3-(6-methoxynaphthalen-1-yl)propyl]piperidine;hydrochloride
PubChem CID11645434
Molecular FormulaC19H26ClNO
Molecular Weight319.88 g/mol
Exact Mass319.17
IUPAC Name1-[3-(6-methoxynaphthalen-1-yl)propyl]piperidine;hydrochloride
SMILESCOc1ccc2c(CCCN3CCCCC3)cccc2c1.Cl
InChIInChI=1S/C19H25NO.ClH/c1-21-18-10-11-19-16(7-5-8-17(19)15-18)9-6-14-20-12-3-2-4-13-20;/h5,7-8,10-11,15H,2-4,6,9,12-14H2,1H3;1H
InChIKeyMCFPYFNQAUCIQW-UHFFFAOYSA-N
XLogP4.69
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.88
LogP ≤ 54.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

CID 82148
CID 82148
CID 96918
CID 96918
CID 10474335
CID 10474335
CID 3071631
CID 3071631
CID 3071635
CID 3071635
CID 3071652
CID 3071652
CID 44352179
CID 44352179
CID 10245193
CID 10245193
CID 3057765
CID 3057765
CID 3057767
CID 3057767
CID 3057789
CID 3057789
CID 3071630
CID 3071630

Frequently Asked Questions

What is the IUPAC name of 1-[3-(6-methoxynaphthalen-1-yl)propyl]piperidine;hydrochloride?
The IUPAC name of 1-[3-(6-methoxynaphthalen-1-yl)propyl]piperidine;hydrochloride (CID 11645434) is 1-[3-(6-methoxynaphthalen-1-yl)propyl]piperidine;hydrochloride.
What is the SMILES notation for 1-[3-(6-methoxynaphthalen-1-yl)propyl]piperidine;hydrochloride?
The canonical SMILES for 1-[3-(6-methoxynaphthalen-1-yl)propyl]piperidine;hydrochloride is COc1ccc2c(CCCN3CCCCC3)cccc2c1.Cl.
What is the InChIKey of 1-[3-(6-methoxynaphthalen-1-yl)propyl]piperidine;hydrochloride?
The InChIKey is MCFPYFNQAUCIQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO.ClH/c1-21-18-10-11-19-16(7-5-8-17(19)15-18)9-6-14-20-12-3-2-4-13-20;/h5,7-8,10-11,15H,2-4,6,9,12-14H2,1H3;1H.
What are the key properties of 1-[3-(6-methoxynaphthalen-1-yl)propyl]piperidine;hydrochloride?
1-[3-(6-methoxynaphthalen-1-yl)propyl]piperidine;hydrochloride has a molecular weight of 319.88 g/mol, XLogP of 4.69, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(6-methoxynaphthalen-1-yl)propyl]piperidine;hydrochloride is sourced from PubChem (CID 11645434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).