4-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)-N-propylpentan-1-amine

C17H33NO — CID 79915623

IUPAC4-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)-N-propylpentan-1-amine
SMILESCCCNC(CCC(C)C)C1CCOC2(CCC2)C1
InChIInChI=1S/C17H33NO/c1-4-11-18-16(7-6-14(2)3)15-8-12-19-17(13-15)9-5-10-17/h14-16,18H,4-13H2,1-3H3
InChIKeyUVQNDRHJFXDCDT-UHFFFAOYSA-N
MW267.46 g/mol
LogP4.14
Rot. Bonds7

About 4-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)-N-propylpentan-1-amine

4-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)-N-propylpentan-1-amine (PubChem CID 79915623) has the molecular formula C17H33NO and a molecular weight of 267.46 g/mol. Its IUPAC name is 4-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)-N-propylpentan-1-amine.

Molecular Properties

Compound Name4-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)-N-propylpentan-1-amine
PubChem CID79915623
Molecular FormulaC17H33NO
Molecular Weight267.46 g/mol
Exact Mass267.26
IUPAC Name4-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)-N-propylpentan-1-amine
SMILESCCCNC(CCC(C)C)C1CCOC2(CCC2)C1
InChIInChI=1S/C17H33NO/c1-4-11-18-16(7-6-14(2)3)15-8-12-19-17(13-15)9-5-10-17/h14-16,18H,4-13H2,1-3H3
InChIKeyUVQNDRHJFXDCDT-UHFFFAOYSA-N
XLogP4.14
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.46
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)-N-propylpentan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(1-oxaspiro[5.5]undecan-4-yl)-N-propylpentan-1-amine
CID 79911364
3-methoxy-1-(1-oxaspiro[5.5]undecan-4-yl)-N-propylpropan-1-amine
CID 79915501
1-(1,9-dioxaspiro[5.5]undecan-4-yl)-N-ethyl-4-methylpentan-1-amine
CID 79915050
N-ethyl-3-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)butan-1-amine
CID 79914798
N-[1-(5-oxaspiro[3.5]nonan-8-yl)-2-propoxyethyl]propan-1-amine
CID 79914384
1-(1,9-dioxaspiro[5.5]undecan-4-yl)-N-propylpentan-1-amine
CID 79911722
N-[2-(1,3-dioxolan-2-yl)-1-(6-oxaspiro[4.5]decan-9-yl)ethyl]propan-1-amine
CID 103547014
N-ethyl-4,4,4-trifluoro-1-(5-oxaspiro[3.5]nonan-8-yl)butan-1-amine
CID 79952767
N-[(2-methylcyclopropyl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]propan-1-amine
CID 79911700
1-(2,6-dioxaspiro[4.5]decan-9-yl)-N-propylpropan-1-amine
CID 79915597
N-[oxan-4-yl(6-oxaspiro[4.5]decan-9-yl)methyl]propan-1-amine
CID 79910518
N-[cyclohexyl(6-oxaspiro[4.5]decan-9-yl)methyl]propan-1-amine
CID 79907861

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)-N-propylpentan-1-amine?
The IUPAC name of 4-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)-N-propylpentan-1-amine (CID 79915623) is 4-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)-N-propylpentan-1-amine.
What is the SMILES notation for 4-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)-N-propylpentan-1-amine?
The canonical SMILES for 4-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)-N-propylpentan-1-amine is CCCNC(CCC(C)C)C1CCOC2(CCC2)C1.
What is the InChIKey of 4-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)-N-propylpentan-1-amine?
The InChIKey is UVQNDRHJFXDCDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33NO/c1-4-11-18-16(7-6-14(2)3)15-8-12-19-17(13-15)9-5-10-17/h14-16,18H,4-13H2,1-3H3.
What are the key properties of 4-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)-N-propylpentan-1-amine?
4-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)-N-propylpentan-1-amine has a molecular weight of 267.46 g/mol, XLogP of 4.14, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)-N-propylpentan-1-amine is sourced from PubChem (CID 79915623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).