N-methyl-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)-1-piperidin-3-ylmethanamine

C16H30N2O — CID 106637126

IUPACN-methyl-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)-1-piperidin-3-ylmethanamine
SMILESCN(CC1CCCNC1)CC1CCC2(CCCC2)O1
InChIInChI=1S/C16H30N2O/c1-18(12-14-5-4-10-17-11-14)13-15-6-9-16(19-15)7-2-3-8-16/h14-15,17H,2-13H2,1H3
InChIKeyOEQIMHQLJRUXIV-UHFFFAOYSA-N
MW266.43 g/mol
LogP2.41
Rot. Bonds4

About N-methyl-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)-1-piperidin-3-ylmethanamine

N-methyl-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)-1-piperidin-3-ylmethanamine (PubChem CID 106637126) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is N-methyl-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)-1-piperidin-3-ylmethanamine.

Molecular Properties

Compound NameN-methyl-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)-1-piperidin-3-ylmethanamine
PubChem CID106637126
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC NameN-methyl-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)-1-piperidin-3-ylmethanamine
SMILESCN(CC1CCCNC1)CC1CCC2(CCCC2)O1
InChIInChI=1S/C16H30N2O/c1-18(12-14-5-4-10-17-11-14)13-15-6-9-16(19-15)7-2-3-8-16/h14-15,17H,2-13H2,1H3
InChIKeyOEQIMHQLJRUXIV-UHFFFAOYSA-N
XLogP2.41
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-methyl-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)-1-piperidin-3-ylmethanamine 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-cyclohexyl-N-methyl-N-(piperidin-3-ylmethyl)methanamine;hydrochloride
CID 119930005
1-cyclobutyl-N-methyl-N-(pyrrolidin-3-ylmethyl)methanamine
CID 62860068
N-[(5,5-dimethyloxolan-2-yl)methyl]-N-(piperidin-3-ylmethyl)cyclopropanamine
CID 106640288
N,N'-dimethyl-N'-(1-oxaspiro[4.4]nonan-2-ylmethyl)ethane-1,2-diamine
CID 102898474
N-methyl-N-(oxolan-3-ylmethyl)-1-piperidin-3-ylmethanamine;hydrochloride
CID 119932323
N-(1-oxaspiro[4.4]nonan-2-ylmethyl)-N-propylpyrrolidin-3-amine
CID 102899394
N-(cyclobutylmethyl)-N-methyl-3-piperidin-3-ylpropan-1-amine
CID 62861568
2,2-difluoro-N-methyl-N-(piperidin-3-ylmethyl)propan-1-amine
CID 84674393
3-(1-oxaspiro[4.4]nonan-2-ylmethylsulfanylmethyl)azetidine
CID 102898419
N-(1-oxaspiro[4.5]decan-2-ylmethyl)-N-propylazetidin-3-amine
CID 102899443
N-methyl-2-(oxan-4-yl)-N-(piperidin-3-ylmethyl)ethanamine
CID 115209752
3-[methyl(piperidin-3-ylmethyl)amino]propanenitrile
CID 80554591

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)-1-piperidin-3-ylmethanamine?
The IUPAC name of N-methyl-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)-1-piperidin-3-ylmethanamine (CID 106637126) is N-methyl-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)-1-piperidin-3-ylmethanamine.
What is the SMILES notation for N-methyl-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)-1-piperidin-3-ylmethanamine?
The canonical SMILES for N-methyl-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)-1-piperidin-3-ylmethanamine is CN(CC1CCCNC1)CC1CCC2(CCCC2)O1.
What is the InChIKey of N-methyl-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)-1-piperidin-3-ylmethanamine?
The InChIKey is OEQIMHQLJRUXIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c1-18(12-14-5-4-10-17-11-14)13-15-6-9-16(19-15)7-2-3-8-16/h14-15,17H,2-13H2,1H3.
What are the key properties of N-methyl-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)-1-piperidin-3-ylmethanamine?
N-methyl-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)-1-piperidin-3-ylmethanamine has a molecular weight of 266.43 g/mol, XLogP of 2.41, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)-1-piperidin-3-ylmethanamine is sourced from PubChem (CID 106637126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).