2-(6-benzyl-3-pyridinyl)ethanamine

C14H16N2 — CID 117001758

IUPAC2-(6-benzyl-3-pyridinyl)ethanamine
SMILESNCCc1ccc(Cc2ccccc2)nc1
InChIInChI=1S/C14H16N2/c15-9-8-13-6-7-14(16-11-13)10-12-4-2-1-3-5-12/h1-7,11H,8-10,15H2
InChIKeyOBEFUBSEWBLJAS-UHFFFAOYSA-N
MW212.30 g/mol
LogP2.17
Rot. Bonds4

About 2-(6-benzyl-3-pyridinyl)ethanamine

2-(6-benzyl-3-pyridinyl)ethanamine (PubChem CID 117001758) has the molecular formula C14H16N2 and a molecular weight of 212.30 g/mol. Its IUPAC name is 2-(6-benzyl-3-pyridinyl)ethanamine.

Molecular Properties

Compound Name2-(6-benzyl-3-pyridinyl)ethanamine
PubChem CID117001758
Molecular FormulaC14H16N2
Molecular Weight212.30 g/mol
Exact Mass212.13
IUPAC Name2-(6-benzyl-3-pyridinyl)ethanamine
SMILESNCCc1ccc(Cc2ccccc2)nc1
InChIInChI=1S/C14H16N2/c15-9-8-13-6-7-14(16-11-13)10-12-4-2-1-3-5-12/h1-7,11H,8-10,15H2
InChIKeyOBEFUBSEWBLJAS-UHFFFAOYSA-N
XLogP2.17
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.30
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(6-benzyl-3-pyridinyl)ethanamine?
The IUPAC name of 2-(6-benzyl-3-pyridinyl)ethanamine (CID 117001758) is 2-(6-benzyl-3-pyridinyl)ethanamine.
What is the SMILES notation for 2-(6-benzyl-3-pyridinyl)ethanamine?
The canonical SMILES for 2-(6-benzyl-3-pyridinyl)ethanamine is NCCc1ccc(Cc2ccccc2)nc1.
What is the InChIKey of 2-(6-benzyl-3-pyridinyl)ethanamine?
The InChIKey is OBEFUBSEWBLJAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2/c15-9-8-13-6-7-14(16-11-13)10-12-4-2-1-3-5-12/h1-7,11H,8-10,15H2.
What are the key properties of 2-(6-benzyl-3-pyridinyl)ethanamine?
2-(6-benzyl-3-pyridinyl)ethanamine has a molecular weight of 212.30 g/mol, XLogP of 2.17, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-benzyl-3-pyridinyl)ethanamine is sourced from PubChem (CID 117001758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).