N-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)-3-pyridin-2-ylpropan-1-amine

C17H26N2O — CID 105166307

IUPACN-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)-3-pyridin-2-ylpropan-1-amine
SMILESCNC(CCc1ccccn1)C1CCOC2(CCC2)C1
InChIInChI=1S/C17H26N2O/c1-18-16(7-6-15-5-2-3-11-19-15)14-8-12-20-17(13-14)9-4-10-17/h2-3,5,11,14,16,18H,4,6-10,12-13H2,1H3
InChIKeyBKKCRZCPTULKMN-UHFFFAOYSA-N
MW274.41 g/mol
LogP2.95
Rot. Bonds5

About N-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)-3-pyridin-2-ylpropan-1-amine

N-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)-3-pyridin-2-ylpropan-1-amine (PubChem CID 105166307) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is N-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)-3-pyridin-2-ylpropan-1-amine.

Molecular Properties

Compound NameN-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)-3-pyridin-2-ylpropan-1-amine
PubChem CID105166307
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC NameN-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)-3-pyridin-2-ylpropan-1-amine
SMILESCNC(CCc1ccccn1)C1CCOC2(CCC2)C1
InChIInChI=1S/C17H26N2O/c1-18-16(7-6-15-5-2-3-11-19-15)14-8-12-20-17(13-14)9-4-10-17/h2-3,5,11,14,16,18H,4,6-10,12-13H2,1H3
InChIKeyBKKCRZCPTULKMN-UHFFFAOYSA-N
XLogP2.95
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)-3-pyridin-2-ylpropan-1-amine with MolForge

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Related Compounds

[1-(6-oxaspiro[4.5]decan-9-yl)-3-pyridin-2-ylpropyl]hydrazine
CID 105325468
1-(6-oxaspiro[4.5]decan-9-yl)-3-pyridin-2-ylpropan-1-amine
CID 105170221
1-(1,9-dioxaspiro[5.5]undecan-4-yl)-3-pyridin-2-ylpropan-1-amine
CID 105167578
2-(2-fluorophenyl)-N-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)ethanamine
CID 79914933
1-(4-ethylcyclohexyl)-N-methyl-3-pyridin-2-ylpropan-1-amine
CID 105155309
[1-(5-oxaspiro[3.5]nonan-8-yl)-3-phenylpropyl]hydrazine
CID 105205823
2-(2-chlorophenyl)-N-methyl-1-(6-oxaspiro[4.5]decan-9-yl)ethanamine
CID 79908675
1-cyclopentyl-N-ethyl-3-pyridin-2-ylpropan-1-amine
CID 105081102
2-methoxy-N-methyl-1-(6-oxaspiro[4.5]decan-9-yl)ethanamine
CID 79915502
N-methyl-1-(6-oxa-2-thiaspiro[4.5]decan-9-yl)-3-pyridin-4-ylpropan-1-amine
CID 105170669
N-methyl-1-(oxolan-3-yl)-2-pyridin-2-ylethanamine
CID 63563236
N-methyl-1-(1-oxaspiro[5.5]undecan-4-yl)-3-propoxypropan-1-amine
CID 105169809

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)-3-pyridin-2-ylpropan-1-amine?
The IUPAC name of N-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)-3-pyridin-2-ylpropan-1-amine (CID 105166307) is N-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)-3-pyridin-2-ylpropan-1-amine.
What is the SMILES notation for N-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)-3-pyridin-2-ylpropan-1-amine?
The canonical SMILES for N-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)-3-pyridin-2-ylpropan-1-amine is CNC(CCc1ccccn1)C1CCOC2(CCC2)C1.
What is the InChIKey of N-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)-3-pyridin-2-ylpropan-1-amine?
The InChIKey is BKKCRZCPTULKMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-18-16(7-6-15-5-2-3-11-19-15)14-8-12-20-17(13-14)9-4-10-17/h2-3,5,11,14,16,18H,4,6-10,12-13H2,1H3.
What are the key properties of N-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)-3-pyridin-2-ylpropan-1-amine?
N-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)-3-pyridin-2-ylpropan-1-amine has a molecular weight of 274.41 g/mol, XLogP of 2.95, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)-3-pyridin-2-ylpropan-1-amine is sourced from PubChem (CID 105166307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).