1-(2-naphthalen-1-yloxyethyl)-4-(triazol-1-yl)piperidine

C19H22N4O — CID 71910805

IUPAC1-(2-naphthalen-1-yloxyethyl)-4-(triazol-1-yl)piperidine
SMILESc1ccc2c(OCCN3CCC(n4ccnn4)CC3)cccc2c1
InChIInChI=1S/C19H22N4O/c1-2-6-18-16(4-1)5-3-7-19(18)24-15-14-22-11-8-17(9-12-22)23-13-10-20-21-23/h1-7,10,13,17H,8-9,11-12,14-15H2
InChIKeyIIEYGJHDEFTVCJ-UHFFFAOYSA-N
MW322.41 g/mol
LogP3.15
Rot. Bonds5

About 1-(2-naphthalen-1-yloxyethyl)-4-(triazol-1-yl)piperidine

1-(2-naphthalen-1-yloxyethyl)-4-(triazol-1-yl)piperidine (PubChem CID 71910805) has the molecular formula C19H22N4O and a molecular weight of 322.41 g/mol. Its IUPAC name is 1-(2-naphthalen-1-yloxyethyl)-4-(triazol-1-yl)piperidine.

Molecular Properties

Compound Name1-(2-naphthalen-1-yloxyethyl)-4-(triazol-1-yl)piperidine
PubChem CID71910805
Molecular FormulaC19H22N4O
Molecular Weight322.41 g/mol
Exact Mass322.18
IUPAC Name1-(2-naphthalen-1-yloxyethyl)-4-(triazol-1-yl)piperidine
SMILESc1ccc2c(OCCN3CCC(n4ccnn4)CC3)cccc2c1
InChIInChI=1S/C19H22N4O/c1-2-6-18-16(4-1)5-3-7-19(18)24-15-14-22-11-8-17(9-12-22)23-13-10-20-21-23/h1-7,10,13,17H,8-9,11-12,14-15H2
InChIKeyIIEYGJHDEFTVCJ-UHFFFAOYSA-N
XLogP3.15
TPSA43.18 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.41
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-(2-naphthalen-1-yloxyethyl)-4-pyrrolidin-1-ylpiperidine
CID 48568943
4-(2-naphthalen-1-yloxyethyl)thiomorpholine
CID 48568928
1-(2-naphthalen-1-yloxyethyl)pyrrolidin-3-amine
CID 71151906
1-(2-naphthalen-1-yloxyethyl)piperidin-4-one
CID 39368285
[1-(2-naphthalen-1-yloxyethyl)azetidin-3-yl]methanamine
CID 71151801
1-(4-naphthalen-1-yloxybutyl)azepane
CID 2195259
1-methyl-N-[1-(2-naphthalen-1-yloxyethyl)piperidin-4-yl]pyrazole-4-carboxamide
CID 47079917
methane;1-(5-naphthalen-1-yloxypentyl)pyrrolidine
CID 160697643
3-(chloromethyl)-1-(3-naphthalen-1-yloxypropyl)pyrrolidine
CID 57150141
2-naphthalen-1-yloxy-1-[(2S)-2-(triazol-1-ylmethyl)pyrrolidin-1-yl]ethanone
CID 120949565
3,5-dimethyl-1-(2-naphthalen-1-yloxyethyl)piperidine;oxalic acid
CID 2924114
3-[1-[2-(1H-indol-4-yloxy)ethyl]piperidin-4-yl]-1H-indole
CID 134100949

Frequently Asked Questions

What is the IUPAC name of 1-(2-naphthalen-1-yloxyethyl)-4-(triazol-1-yl)piperidine?
The IUPAC name of 1-(2-naphthalen-1-yloxyethyl)-4-(triazol-1-yl)piperidine (CID 71910805) is 1-(2-naphthalen-1-yloxyethyl)-4-(triazol-1-yl)piperidine.
What is the SMILES notation for 1-(2-naphthalen-1-yloxyethyl)-4-(triazol-1-yl)piperidine?
The canonical SMILES for 1-(2-naphthalen-1-yloxyethyl)-4-(triazol-1-yl)piperidine is c1ccc2c(OCCN3CCC(n4ccnn4)CC3)cccc2c1.
What is the InChIKey of 1-(2-naphthalen-1-yloxyethyl)-4-(triazol-1-yl)piperidine?
The InChIKey is IIEYGJHDEFTVCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O/c1-2-6-18-16(4-1)5-3-7-19(18)24-15-14-22-11-8-17(9-12-22)23-13-10-20-21-23/h1-7,10,13,17H,8-9,11-12,14-15H2.
What are the key properties of 1-(2-naphthalen-1-yloxyethyl)-4-(triazol-1-yl)piperidine?
1-(2-naphthalen-1-yloxyethyl)-4-(triazol-1-yl)piperidine has a molecular weight of 322.41 g/mol, XLogP of 3.15, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-naphthalen-1-yloxyethyl)-4-(triazol-1-yl)piperidine is sourced from PubChem (CID 71910805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).