2-[4-(4-ethylphenyl)piperidin-1-yl]ethanamine

C15H24N2 — CID 82128932

IUPAC2-[4-(4-ethylphenyl)piperidin-1-yl]ethanamine
SMILESCCc1ccc(C2CCN(CCN)CC2)cc1
InChIInChI=1S/C15H24N2/c1-2-13-3-5-14(6-4-13)15-7-10-17(11-8-15)12-9-16/h3-6,15H,2,7-12,16H2,1H3
InChIKeyIPGCPUZAFWSTAP-UHFFFAOYSA-N
MW232.37 g/mol
LogP2.39
Rot. Bonds4

About 2-[4-(4-ethylphenyl)piperidin-1-yl]ethanamine

2-[4-(4-ethylphenyl)piperidin-1-yl]ethanamine (PubChem CID 82128932) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 2-[4-(4-ethylphenyl)piperidin-1-yl]ethanamine.

Molecular Properties

Compound Name2-[4-(4-ethylphenyl)piperidin-1-yl]ethanamine
PubChem CID82128932
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name2-[4-(4-ethylphenyl)piperidin-1-yl]ethanamine
SMILESCCc1ccc(C2CCN(CCN)CC2)cc1
InChIInChI=1S/C15H24N2/c1-2-13-3-5-14(6-4-13)15-7-10-17(11-8-15)12-9-16/h3-6,15H,2,7-12,16H2,1H3
InChIKeyIPGCPUZAFWSTAP-UHFFFAOYSA-N
XLogP2.39
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(4-ethylphenyl)piperidin-1-yl]ethanamine?
The IUPAC name of 2-[4-(4-ethylphenyl)piperidin-1-yl]ethanamine (CID 82128932) is 2-[4-(4-ethylphenyl)piperidin-1-yl]ethanamine.
What is the SMILES notation for 2-[4-(4-ethylphenyl)piperidin-1-yl]ethanamine?
The canonical SMILES for 2-[4-(4-ethylphenyl)piperidin-1-yl]ethanamine is CCc1ccc(C2CCN(CCN)CC2)cc1.
What is the InChIKey of 2-[4-(4-ethylphenyl)piperidin-1-yl]ethanamine?
The InChIKey is IPGCPUZAFWSTAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-2-13-3-5-14(6-4-13)15-7-10-17(11-8-15)12-9-16/h3-6,15H,2,7-12,16H2,1H3.
What are the key properties of 2-[4-(4-ethylphenyl)piperidin-1-yl]ethanamine?
2-[4-(4-ethylphenyl)piperidin-1-yl]ethanamine has a molecular weight of 232.37 g/mol, XLogP of 2.39, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(4-ethylphenyl)piperidin-1-yl]ethanamine is sourced from PubChem (CID 82128932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).