2-piperidin-2-yl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine

C17H26N2 — CID 83987668

IUPAC2-piperidin-2-yl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine
SMILESNCC(c1ccc2c(c1)CCCC2)C1CCCCN1
InChIInChI=1S/C17H26N2/c18-12-16(17-7-3-4-10-19-17)15-9-8-13-5-1-2-6-14(13)11-15/h8-9,11,16-17,19H,1-7,10,12,18H2
InChIKeyCWVAFSQSQBCMEU-UHFFFAOYSA-N
MW258.41 g/mol
LogP2.75
Rot. Bonds3

About 2-piperidin-2-yl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine

2-piperidin-2-yl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine (PubChem CID 83987668) has the molecular formula C17H26N2 and a molecular weight of 258.41 g/mol. Its IUPAC name is 2-piperidin-2-yl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine.

Molecular Properties

Compound Name2-piperidin-2-yl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine
PubChem CID83987668
Molecular FormulaC17H26N2
Molecular Weight258.41 g/mol
Exact Mass258.21
IUPAC Name2-piperidin-2-yl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine
SMILESNCC(c1ccc2c(c1)CCCC2)C1CCCCN1
InChIInChI=1S/C17H26N2/c18-12-16(17-7-3-4-10-19-17)15-9-8-13-5-1-2-6-14(13)11-15/h8-9,11,16-17,19H,1-7,10,12,18H2
InChIKeyCWVAFSQSQBCMEU-UHFFFAOYSA-N
XLogP2.75
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-piperidin-2-yl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine?
The IUPAC name of 2-piperidin-2-yl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine (CID 83987668) is 2-piperidin-2-yl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine.
What is the SMILES notation for 2-piperidin-2-yl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine?
The canonical SMILES for 2-piperidin-2-yl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine is NCC(c1ccc2c(c1)CCCC2)C1CCCCN1.
What is the InChIKey of 2-piperidin-2-yl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine?
The InChIKey is CWVAFSQSQBCMEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2/c18-12-16(17-7-3-4-10-19-17)15-9-8-13-5-1-2-6-14(13)11-15/h8-9,11,16-17,19H,1-7,10,12,18H2.
What are the key properties of 2-piperidin-2-yl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine?
2-piperidin-2-yl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine has a molecular weight of 258.41 g/mol, XLogP of 2.75, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperidin-2-yl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine is sourced from PubChem (CID 83987668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).