4-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)piperidine

C16H23N — CID 23294446

IUPAC4-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)piperidine
SMILESc1cc2c(cc1CC1CCNCC1)CCCC2
InChIInChI=1S/C16H23N/c1-2-4-16-12-14(5-6-15(16)3-1)11-13-7-9-17-10-8-13/h5-6,12-13,17H,1-4,7-11H2
InChIKeyQODIEDINNDPQJT-UHFFFAOYSA-N
MW229.37 g/mol
LogP3.11
Rot. Bonds2

About 4-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)piperidine

4-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)piperidine (PubChem CID 23294446) has the molecular formula C16H23N and a molecular weight of 229.37 g/mol. Its IUPAC name is 4-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)piperidine.

Molecular Properties

Compound Name4-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)piperidine
PubChem CID23294446
Molecular FormulaC16H23N
Molecular Weight229.37 g/mol
Exact Mass229.18
IUPAC Name4-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)piperidine
SMILESc1cc2c(cc1CC1CCNCC1)CCCC2
InChIInChI=1S/C16H23N/c1-2-4-16-12-14(5-6-15(16)3-1)11-13-7-9-17-10-8-13/h5-6,12-13,17H,1-4,7-11H2
InChIKeyQODIEDINNDPQJT-UHFFFAOYSA-N
XLogP3.11
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.37
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-[(3-methyl-2,3-dihydro-1H-inden-5-yl)methyl]piperidine
CID 84793092
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CID 84796490
6-(piperidin-4-ylmethyl)-3,4-dihydro-1H-quinolin-2-one
CID 82232043
3-(3,4-dihydro-1H-isochromen-6-ylmethyl)pyrrolidine
CID 84785512
4-[(3,4-dichlorophenyl)methyl]azepane
CID 83261164
5-(piperidin-4-ylmethyl)-1,3-dihydroindol-2-one
CID 82231323
3-(2,3-dihydro-1H-inden-5-ylmethyl)-4-methylpiperidine
CID 106779364
5-(piperidin-4-ylmethyl)-2H-benzotriazole
CID 84784846
4-[(7-bromo-2,3-dihydro-1H-inden-5-yl)methyl]piperidine
CID 84815312
4-(piperidin-4-ylmethyl)phenol
CID 17039495
4-[[4-(fluoromethyl)phenyl]methyl]piperidine
CID 84675538
5-(2,3-dihydro-1H-inden-5-ylmethyl)-2-methylpiperidine
CID 106779365

Frequently Asked Questions

What is the IUPAC name of 4-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)piperidine?
The IUPAC name of 4-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)piperidine (CID 23294446) is 4-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)piperidine.
What is the SMILES notation for 4-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)piperidine?
The canonical SMILES for 4-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)piperidine is c1cc2c(cc1CC1CCNCC1)CCCC2.
What is the InChIKey of 4-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)piperidine?
The InChIKey is QODIEDINNDPQJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N/c1-2-4-16-12-14(5-6-15(16)3-1)11-13-7-9-17-10-8-13/h5-6,12-13,17H,1-4,7-11H2.
What are the key properties of 4-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)piperidine?
4-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)piperidine has a molecular weight of 229.37 g/mol, XLogP of 3.11, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)piperidine is sourced from PubChem (CID 23294446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).