N-(3-ethoxyspiro[3.5]nonan-1-yl)pyridin-3-amine

C16H24N2O — CID 65170359

IUPACN-(3-ethoxyspiro[3.5]nonan-1-yl)pyridin-3-amine
SMILESCCOC1CC(Nc2cccnc2)C12CCCCC2
InChIInChI=1S/C16H24N2O/c1-2-19-15-11-14(16(15)8-4-3-5-9-16)18-13-7-6-10-17-12-13/h6-7,10,12,14-15,18H,2-5,8-9,11H2,1H3
InChIKeyIUFOHNBAROTSEH-UHFFFAOYSA-N
MW260.38 g/mol
LogP3.62
Rot. Bonds4

About N-(3-ethoxyspiro[3.5]nonan-1-yl)pyridin-3-amine

N-(3-ethoxyspiro[3.5]nonan-1-yl)pyridin-3-amine (PubChem CID 65170359) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is N-(3-ethoxyspiro[3.5]nonan-1-yl)pyridin-3-amine.

Molecular Properties

Compound NameN-(3-ethoxyspiro[3.5]nonan-1-yl)pyridin-3-amine
PubChem CID65170359
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC NameN-(3-ethoxyspiro[3.5]nonan-1-yl)pyridin-3-amine
SMILESCCOC1CC(Nc2cccnc2)C12CCCCC2
InChIInChI=1S/C16H24N2O/c1-2-19-15-11-14(16(15)8-4-3-5-9-16)18-13-7-6-10-17-12-13/h6-7,10,12,14-15,18H,2-5,8-9,11H2,1H3
InChIKeyIUFOHNBAROTSEH-UHFFFAOYSA-N
XLogP3.62
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3-ethoxyspiro[3.5]nonan-1-yl)pyridin-3-amine?
The IUPAC name of N-(3-ethoxyspiro[3.5]nonan-1-yl)pyridin-3-amine (CID 65170359) is N-(3-ethoxyspiro[3.5]nonan-1-yl)pyridin-3-amine.
What is the SMILES notation for N-(3-ethoxyspiro[3.5]nonan-1-yl)pyridin-3-amine?
The canonical SMILES for N-(3-ethoxyspiro[3.5]nonan-1-yl)pyridin-3-amine is CCOC1CC(Nc2cccnc2)C12CCCCC2.
What is the InChIKey of N-(3-ethoxyspiro[3.5]nonan-1-yl)pyridin-3-amine?
The InChIKey is IUFOHNBAROTSEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-2-19-15-11-14(16(15)8-4-3-5-9-16)18-13-7-6-10-17-12-13/h6-7,10,12,14-15,18H,2-5,8-9,11H2,1H3.
What are the key properties of N-(3-ethoxyspiro[3.5]nonan-1-yl)pyridin-3-amine?
N-(3-ethoxyspiro[3.5]nonan-1-yl)pyridin-3-amine has a molecular weight of 260.38 g/mol, XLogP of 3.62, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethoxyspiro[3.5]nonan-1-yl)pyridin-3-amine is sourced from PubChem (CID 65170359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).