2-methyl-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)oxolan-3-amine

C14H25NO2 — CID 102897677

IUPAC2-methyl-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)oxolan-3-amine
SMILESCC1OCCC1NCC1CCC2(CCCC2)O1
InChIInChI=1S/C14H25NO2/c1-11-13(5-9-16-11)15-10-12-4-8-14(17-12)6-2-3-7-14/h11-13,15H,2-10H2,1H3
InChIKeyNJXVYRBTSXXDCT-UHFFFAOYSA-N
MW239.36 g/mol
LogP2.25
Rot. Bonds3

About 2-methyl-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)oxolan-3-amine

2-methyl-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)oxolan-3-amine (PubChem CID 102897677) has the molecular formula C14H25NO2 and a molecular weight of 239.36 g/mol. Its IUPAC name is 2-methyl-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)oxolan-3-amine.

Molecular Properties

Compound Name2-methyl-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)oxolan-3-amine
PubChem CID102897677
Molecular FormulaC14H25NO2
Molecular Weight239.36 g/mol
Exact Mass239.19
IUPAC Name2-methyl-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)oxolan-3-amine
SMILESCC1OCCC1NCC1CCC2(CCCC2)O1
InChIInChI=1S/C14H25NO2/c1-11-13(5-9-16-11)15-10-12-4-8-14(17-12)6-2-3-7-14/h11-13,15H,2-10H2,1H3
InChIKeyNJXVYRBTSXXDCT-UHFFFAOYSA-N
XLogP2.25
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-methyl-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)oxolan-3-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

2,3-dimethyl-N-(1-oxaspiro[4.5]decan-2-ylmethyl)cyclohexan-1-amine
CID 102896724
(2R,3R)-2-methyl-N-[[(2S)-oxolan-2-yl]methyl]oxolan-3-amine
CID 97358136
N-methyl-1-(1-oxaspiro[4.4]nonan-2-yl)methanamine
CID 102896520
N-(1-oxaspiro[4.5]decan-2-ylmethyl)cyclopentanamine
CID 102896553
N-(1,4-dioxan-2-ylmethyl)-2-methyloxolan-3-amine
CID 115336009
N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-2-methyloxolan-3-amine
CID 107386372
1-(1-oxaspiro[4.4]nonan-2-yl)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]methanamine
CID 102897479
2,6-dimethyl-N-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-1-amine
CID 102897697
2-methyl-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)propan-2-amine
CID 102896742
(2R,3S)-N-(cyclopropylmethyl)-2-methyloxolan-3-amine
CID 97358188
1,1-dimethyl-2-(1-oxaspiro[4.5]decan-2-ylmethyl)hydrazine
CID 102897694
N-[(2,2-dimethylcyclopropyl)methyl]-2-methyloxolan-3-amine
CID 103902167

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)oxolan-3-amine?
The IUPAC name of 2-methyl-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)oxolan-3-amine (CID 102897677) is 2-methyl-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)oxolan-3-amine.
What is the SMILES notation for 2-methyl-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)oxolan-3-amine?
The canonical SMILES for 2-methyl-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)oxolan-3-amine is CC1OCCC1NCC1CCC2(CCCC2)O1.
What is the InChIKey of 2-methyl-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)oxolan-3-amine?
The InChIKey is NJXVYRBTSXXDCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO2/c1-11-13(5-9-16-11)15-10-12-4-8-14(17-12)6-2-3-7-14/h11-13,15H,2-10H2,1H3.
What are the key properties of 2-methyl-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)oxolan-3-amine?
2-methyl-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)oxolan-3-amine has a molecular weight of 239.36 g/mol, XLogP of 2.25, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)oxolan-3-amine is sourced from PubChem (CID 102897677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).