2,2-dimethyl-6-[[methyl(oxan-4-ylmethyl)amino]methyl]cyclohexan-1-amine

C16H32N2O — CID 79848492

IUPAC2,2-dimethyl-6-[[methyl(oxan-4-ylmethyl)amino]methyl]cyclohexan-1-amine
SMILESCN(CC1CCOCC1)CC1CCCC(C)(C)C1N
InChIInChI=1S/C16H32N2O/c1-16(2)8-4-5-14(15(16)17)12-18(3)11-13-6-9-19-10-7-13/h13-15H,4-12,17H2,1-3H3
InChIKeyYYNCSQIPPQVVID-UHFFFAOYSA-N
MW268.44 g/mol
LogP2.50
Rot. Bonds4

About 2,2-dimethyl-6-[[methyl(oxan-4-ylmethyl)amino]methyl]cyclohexan-1-amine

2,2-dimethyl-6-[[methyl(oxan-4-ylmethyl)amino]methyl]cyclohexan-1-amine (PubChem CID 79848492) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is 2,2-dimethyl-6-[[methyl(oxan-4-ylmethyl)amino]methyl]cyclohexan-1-amine.

Molecular Properties

Compound Name2,2-dimethyl-6-[[methyl(oxan-4-ylmethyl)amino]methyl]cyclohexan-1-amine
PubChem CID79848492
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC Name2,2-dimethyl-6-[[methyl(oxan-4-ylmethyl)amino]methyl]cyclohexan-1-amine
SMILESCN(CC1CCOCC1)CC1CCCC(C)(C)C1N
InChIInChI=1S/C16H32N2O/c1-16(2)8-4-5-14(15(16)17)12-18(3)11-13-6-9-19-10-7-13/h13-15H,4-12,17H2,1-3H3
InChIKeyYYNCSQIPPQVVID-UHFFFAOYSA-N
XLogP2.50
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2,2-dimethyl-6-[[methyl(oxan-4-ylmethyl)amino]methyl]cyclohexan-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

6-[[cyclobutylmethyl(methyl)amino]methyl]-2,2-dimethylcyclohexan-1-amine
CID 79849427
2,2-dimethyl-6-[[methyl(oxan-4-ylmethyl)amino]methyl]cyclohexan-1-ol
CID 79848513
6-[[ethyl(methyl)amino]methyl]-2,2-dimethylcyclohexan-1-amine
CID 79852215
6-[[cyclohexyl(methyl)amino]methyl]-2,2-dimethylcyclohexan-1-amine
CID 79852212
2,2-dimethyl-6-[[methyl-(3-methylcyclohexyl)amino]methyl]cyclohexan-1-amine
CID 79852665
2,2-dimethyl-6-[[methyl(2-pyridin-4-ylethyl)amino]methyl]cyclohexan-1-amine
CID 79853439
[1-amino-2-[2-[methyl(oxan-4-ylmethyl)amino]ethyl]cyclopentyl]methanol
CID 79571201
4-[[(2-hydroxy-3,3-dimethylcyclohexyl)methyl-methylamino]methyl]oxan-4-ol
CID 114953741
2,2,5,5-tetramethyl-4-[[methyl(oxan-4-ylmethyl)amino]methyl]oxolan-3-ol
CID 79929474
2,2-dimethyl-6-[[methyl-[(4-methyl-1,3-thiazol-5-yl)methyl]amino]methyl]cyclohexan-1-amine
CID 79848805
N-(hydrazinylmethyl)-N-methyl-1-(oxan-4-yl)methanamine
CID 115261041
N-(bromomethyl)-N-methyl-1-(oxan-4-yl)methanamine
CID 115262142

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-6-[[methyl(oxan-4-ylmethyl)amino]methyl]cyclohexan-1-amine?
The IUPAC name of 2,2-dimethyl-6-[[methyl(oxan-4-ylmethyl)amino]methyl]cyclohexan-1-amine (CID 79848492) is 2,2-dimethyl-6-[[methyl(oxan-4-ylmethyl)amino]methyl]cyclohexan-1-amine.
What is the SMILES notation for 2,2-dimethyl-6-[[methyl(oxan-4-ylmethyl)amino]methyl]cyclohexan-1-amine?
The canonical SMILES for 2,2-dimethyl-6-[[methyl(oxan-4-ylmethyl)amino]methyl]cyclohexan-1-amine is CN(CC1CCOCC1)CC1CCCC(C)(C)C1N.
What is the InChIKey of 2,2-dimethyl-6-[[methyl(oxan-4-ylmethyl)amino]methyl]cyclohexan-1-amine?
The InChIKey is YYNCSQIPPQVVID-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-16(2)8-4-5-14(15(16)17)12-18(3)11-13-6-9-19-10-7-13/h13-15H,4-12,17H2,1-3H3.
What are the key properties of 2,2-dimethyl-6-[[methyl(oxan-4-ylmethyl)amino]methyl]cyclohexan-1-amine?
2,2-dimethyl-6-[[methyl(oxan-4-ylmethyl)amino]methyl]cyclohexan-1-amine has a molecular weight of 268.44 g/mol, XLogP of 2.50, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-6-[[methyl(oxan-4-ylmethyl)amino]methyl]cyclohexan-1-amine is sourced from PubChem (CID 79848492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).