4-methoxy-N-(2-methoxy-2-methylpropyl)-4-methylpentan-2-amine

C12H27NO2 — CID 115728657

IUPAC4-methoxy-N-(2-methoxy-2-methylpropyl)-4-methylpentan-2-amine
SMILESCOC(C)(C)CNC(C)CC(C)(C)OC
InChIInChI=1S/C12H27NO2/c1-10(8-11(2,3)14-6)13-9-12(4,5)15-7/h10,13H,8-9H2,1-7H3
InChIKeyQCPAWOUNPCRNOX-UHFFFAOYSA-N
MW217.35 g/mol
LogP2.20
Rot. Bonds7

About 4-methoxy-N-(2-methoxy-2-methylpropyl)-4-methylpentan-2-amine

4-methoxy-N-(2-methoxy-2-methylpropyl)-4-methylpentan-2-amine (PubChem CID 115728657) has the molecular formula C12H27NO2 and a molecular weight of 217.35 g/mol. Its IUPAC name is 4-methoxy-N-(2-methoxy-2-methylpropyl)-4-methylpentan-2-amine.

Molecular Properties

Compound Name4-methoxy-N-(2-methoxy-2-methylpropyl)-4-methylpentan-2-amine
PubChem CID115728657
Molecular FormulaC12H27NO2
Molecular Weight217.35 g/mol
Exact Mass217.20
IUPAC Name4-methoxy-N-(2-methoxy-2-methylpropyl)-4-methylpentan-2-amine
SMILESCOC(C)(C)CNC(C)CC(C)(C)OC
InChIInChI=1S/C12H27NO2/c1-10(8-11(2,3)14-6)13-9-12(4,5)15-7/h10,13H,8-9H2,1-7H3
InChIKeyQCPAWOUNPCRNOX-UHFFFAOYSA-N
XLogP2.20
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.35
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(4-methoxy-4-methylpentan-2-yl)amino]-2-methylpropan-2-ol
CID 65103997
1-[(4-methoxy-4-methylpentan-2-yl)amino]-2-methylbutan-2-ol
CID 65108055
N-(2-methoxy-2-methylpropyl)nonan-2-amine
CID 104759526
4-[(2-methoxy-2-methylpropyl)amino]pentanoic acid
CID 104759577
N-(4-methoxy-4-methylpentan-2-yl)hydroxylamine
CID 82684700
[(2R)-4-methoxy-4-methylpentan-2-yl]hydrazine
CID 29014952
3-[(2-methoxy-2-methylpropyl)amino]-N-methylbutanamide
CID 115728614
methyl 4-[(2-methoxy-2-methylpropyl)amino]-2-methylpentanoate
CID 104646437
N-(3,3-dimethylbutyl)-4-methoxy-4-methylpentan-2-amine
CID 115712795
2-[(2-methoxy-2-methylpropyl)amino]propanenitrile
CID 104760516
4-methoxy-4-methyl-N-(3,3,3-trifluoropropyl)pentan-2-amine
CID 63226548
4-methoxy-4-methyl-N-(2-propan-2-yloxyethyl)pentan-2-amine
CID 104584741

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-(2-methoxy-2-methylpropyl)-4-methylpentan-2-amine?
The IUPAC name of 4-methoxy-N-(2-methoxy-2-methylpropyl)-4-methylpentan-2-amine (CID 115728657) is 4-methoxy-N-(2-methoxy-2-methylpropyl)-4-methylpentan-2-amine.
What is the SMILES notation for 4-methoxy-N-(2-methoxy-2-methylpropyl)-4-methylpentan-2-amine?
The canonical SMILES for 4-methoxy-N-(2-methoxy-2-methylpropyl)-4-methylpentan-2-amine is COC(C)(C)CNC(C)CC(C)(C)OC.
What is the InChIKey of 4-methoxy-N-(2-methoxy-2-methylpropyl)-4-methylpentan-2-amine?
The InChIKey is QCPAWOUNPCRNOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27NO2/c1-10(8-11(2,3)14-6)13-9-12(4,5)15-7/h10,13H,8-9H2,1-7H3.
What are the key properties of 4-methoxy-N-(2-methoxy-2-methylpropyl)-4-methylpentan-2-amine?
4-methoxy-N-(2-methoxy-2-methylpropyl)-4-methylpentan-2-amine has a molecular weight of 217.35 g/mol, XLogP of 2.20, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-(2-methoxy-2-methylpropyl)-4-methylpentan-2-amine is sourced from PubChem (CID 115728657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).