1-[(2-ethoxynaphthalen-1-yl)methyl]piperidine

C18H23NO — CID 141150961

IUPAC1-[(2-ethoxynaphthalen-1-yl)methyl]piperidine
SMILESCCOc1ccc2ccccc2c1CN1CCCCC1
InChIInChI=1S/C18H23NO/c1-2-20-18-11-10-15-8-4-5-9-16(15)17(18)14-19-12-6-3-7-13-19/h4-5,8-11H,2-3,6-7,12-14H2,1H3
InChIKeyZCEHDNFSZWGGET-UHFFFAOYSA-N
MW269.39 g/mol
LogP4.22
Rot. Bonds4

About 1-[(2-ethoxynaphthalen-1-yl)methyl]piperidine

1-[(2-ethoxynaphthalen-1-yl)methyl]piperidine (PubChem CID 141150961) has the molecular formula C18H23NO and a molecular weight of 269.39 g/mol. Its IUPAC name is 1-[(2-ethoxynaphthalen-1-yl)methyl]piperidine.

Molecular Properties

Compound Name1-[(2-ethoxynaphthalen-1-yl)methyl]piperidine
PubChem CID141150961
Molecular FormulaC18H23NO
Molecular Weight269.39 g/mol
Exact Mass269.18
IUPAC Name1-[(2-ethoxynaphthalen-1-yl)methyl]piperidine
SMILESCCOc1ccc2ccccc2c1CN1CCCCC1
InChIInChI=1S/C18H23NO/c1-2-20-18-11-10-15-8-4-5-9-16(15)17(18)14-19-12-6-3-7-13-19/h4-5,8-11H,2-3,6-7,12-14H2,1H3
InChIKeyZCEHDNFSZWGGET-UHFFFAOYSA-N
XLogP4.22
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 54.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-ethoxyphenyl)-4-[(2-methoxynaphthalen-1-yl)methyl]piperazine
CID 1376192
(3S,4S)-1-[(2-ethoxynaphthalen-1-yl)methyl]-3-hydroxypiperidine-4-carboxylic acid
CID 135094948
1-benzyl-2-ethoxynaphthalene
CID 12064074
2-[4-[(2-methoxynaphthalen-1-yl)methyl]piperazin-1-yl]-1-piperidin-1-ylethanone
CID 112800157
cyclooctyl-[(2-ethoxynaphthalen-1-yl)methyl]azanium
CID 8620919
4-[3-(2-ethoxynaphthalen-1-yl)propyl]morpholine
CID 170869209
N-[[2-(2-pyrrolidin-1-ylethoxy)naphthalen-1-yl]methyl]ethanamine
CID 39313180
(4aS,8aS)-7-[(2-ethoxynaphthalen-1-yl)methyl]-1-methyl-3,4,5,6,8,8a-hexahydro-2H-1,7-naphthyridine-4a-carboxylic acid
CID 134696282
(1R,5S)-3-[(2-ethoxynaphthalen-1-yl)methyl]-3-azabicyclo[3.1.0]hexane-1,5-dicarboxylic acid;2,2,2-trifluoroacetic acid
CID 154916268
(4R,5R)-7-[(2-propoxynaphthalen-1-yl)methyl]-7-azaspiro[4.5]decan-4-ol
CID 135091515
N-[(2-ethoxynaphthalen-1-yl)methyl]-2-morpholin-4-ylethanamine;hydrochloride
CID 6603331
3-[4-[(2-methoxynaphthalen-1-yl)methyl]piperazin-1-yl]propan-1-amine
CID 54855934

Frequently Asked Questions

What is the IUPAC name of 1-[(2-ethoxynaphthalen-1-yl)methyl]piperidine?
The IUPAC name of 1-[(2-ethoxynaphthalen-1-yl)methyl]piperidine (CID 141150961) is 1-[(2-ethoxynaphthalen-1-yl)methyl]piperidine.
What is the SMILES notation for 1-[(2-ethoxynaphthalen-1-yl)methyl]piperidine?
The canonical SMILES for 1-[(2-ethoxynaphthalen-1-yl)methyl]piperidine is CCOc1ccc2ccccc2c1CN1CCCCC1.
What is the InChIKey of 1-[(2-ethoxynaphthalen-1-yl)methyl]piperidine?
The InChIKey is ZCEHDNFSZWGGET-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO/c1-2-20-18-11-10-15-8-4-5-9-16(15)17(18)14-19-12-6-3-7-13-19/h4-5,8-11H,2-3,6-7,12-14H2,1H3.
What are the key properties of 1-[(2-ethoxynaphthalen-1-yl)methyl]piperidine?
1-[(2-ethoxynaphthalen-1-yl)methyl]piperidine has a molecular weight of 269.39 g/mol, XLogP of 4.22, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-ethoxynaphthalen-1-yl)methyl]piperidine is sourced from PubChem (CID 141150961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).