2-pyridin-2-ylnonan-3-amine

C14H24N2 — CID 114753071

IUPAC2-pyridin-2-ylnonan-3-amine
SMILESCCCCCCC(N)C(C)c1ccccn1
InChIInChI=1S/C14H24N2/c1-3-4-5-6-9-13(15)12(2)14-10-7-8-11-16-14/h7-8,10-13H,3-6,9,15H2,1-2H3
InChIKeyXUGZRFIORZRMKL-UHFFFAOYSA-N
MW220.36 g/mol
LogP3.48
Rot. Bonds7

About 2-pyridin-2-ylnonan-3-amine

2-pyridin-2-ylnonan-3-amine (PubChem CID 114753071) has the molecular formula C14H24N2 and a molecular weight of 220.36 g/mol. Its IUPAC name is 2-pyridin-2-ylnonan-3-amine.

Molecular Properties

Compound Name2-pyridin-2-ylnonan-3-amine
PubChem CID114753071
Molecular FormulaC14H24N2
Molecular Weight220.36 g/mol
Exact Mass220.19
IUPAC Name2-pyridin-2-ylnonan-3-amine
SMILESCCCCCCC(N)C(C)c1ccccn1
InChIInChI=1S/C14H24N2/c1-3-4-5-6-9-13(15)12(2)14-10-7-8-11-16-14/h7-8,10-13H,3-6,9,15H2,1-2H3
InChIKeyXUGZRFIORZRMKL-UHFFFAOYSA-N
XLogP3.48
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-pyridin-2-ylnonan-3-amine?
The IUPAC name of 2-pyridin-2-ylnonan-3-amine (CID 114753071) is 2-pyridin-2-ylnonan-3-amine.
What is the SMILES notation for 2-pyridin-2-ylnonan-3-amine?
The canonical SMILES for 2-pyridin-2-ylnonan-3-amine is CCCCCCC(N)C(C)c1ccccn1.
What is the InChIKey of 2-pyridin-2-ylnonan-3-amine?
The InChIKey is XUGZRFIORZRMKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2/c1-3-4-5-6-9-13(15)12(2)14-10-7-8-11-16-14/h7-8,10-13H,3-6,9,15H2,1-2H3.
What are the key properties of 2-pyridin-2-ylnonan-3-amine?
2-pyridin-2-ylnonan-3-amine has a molecular weight of 220.36 g/mol, XLogP of 3.48, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyridin-2-ylnonan-3-amine is sourced from PubChem (CID 114753071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).