1-(6-ethenyl-3-pyridinyl)ethanamine

C9H12N2 — CID 74788745

IUPAC1-(6-ethenyl-3-pyridinyl)ethanamine
SMILESC=Cc1ccc(C(C)N)cn1
InChIInChI=1S/C9H12N2/c1-3-9-5-4-8(6-11-9)7(2)10/h3-7H,1,10H2,2H3
InChIKeyNTNOHSDNBMGBGK-UHFFFAOYSA-N
MW148.21 g/mol
LogP1.74
Rot. Bonds2

About 1-(6-ethenyl-3-pyridinyl)ethanamine

1-(6-ethenyl-3-pyridinyl)ethanamine (PubChem CID 74788745) has the molecular formula C9H12N2 and a molecular weight of 148.21 g/mol. Its IUPAC name is 1-(6-ethenyl-3-pyridinyl)ethanamine.

Molecular Properties

Compound Name1-(6-ethenyl-3-pyridinyl)ethanamine
PubChem CID74788745
Molecular FormulaC9H12N2
Molecular Weight148.21 g/mol
Exact Mass148.10
IUPAC Name1-(6-ethenyl-3-pyridinyl)ethanamine
SMILESC=Cc1ccc(C(C)N)cn1
InChIInChI=1S/C9H12N2/c1-3-9-5-4-8(6-11-9)7(2)10/h3-7H,1,10H2,2H3
InChIKeyNTNOHSDNBMGBGK-UHFFFAOYSA-N
XLogP1.74
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.21
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(6-ethenyl-3-pyridinyl)ethanamine?
The IUPAC name of 1-(6-ethenyl-3-pyridinyl)ethanamine (CID 74788745) is 1-(6-ethenyl-3-pyridinyl)ethanamine.
What is the SMILES notation for 1-(6-ethenyl-3-pyridinyl)ethanamine?
The canonical SMILES for 1-(6-ethenyl-3-pyridinyl)ethanamine is C=Cc1ccc(C(C)N)cn1.
What is the InChIKey of 1-(6-ethenyl-3-pyridinyl)ethanamine?
The InChIKey is NTNOHSDNBMGBGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2/c1-3-9-5-4-8(6-11-9)7(2)10/h3-7H,1,10H2,2H3.
What are the key properties of 1-(6-ethenyl-3-pyridinyl)ethanamine?
1-(6-ethenyl-3-pyridinyl)ethanamine has a molecular weight of 148.21 g/mol, XLogP of 1.74, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-ethenyl-3-pyridinyl)ethanamine is sourced from PubChem (CID 74788745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).