3-(3-methoxy-2,2-dimethylpropoxy)-2,2-dimethylpropan-1-amine

C11H25NO2 — CID 88929360

IUPAC3-(3-methoxy-2,2-dimethylpropoxy)-2,2-dimethylpropan-1-amine
SMILESCOCC(C)(C)COCC(C)(C)CN
InChIInChI=1S/C11H25NO2/c1-10(2,6-12)8-14-9-11(3,4)7-13-5/h6-9,12H2,1-5H3
InChIKeyNVJBRTOZONJTPQ-UHFFFAOYSA-N
MW203.33 g/mol
LogP1.66
Rot. Bonds7

About 3-(3-methoxy-2,2-dimethylpropoxy)-2,2-dimethylpropan-1-amine

3-(3-methoxy-2,2-dimethylpropoxy)-2,2-dimethylpropan-1-amine (PubChem CID 88929360) has the molecular formula C11H25NO2 and a molecular weight of 203.33 g/mol. Its IUPAC name is 3-(3-methoxy-2,2-dimethylpropoxy)-2,2-dimethylpropan-1-amine.

Molecular Properties

Compound Name3-(3-methoxy-2,2-dimethylpropoxy)-2,2-dimethylpropan-1-amine
PubChem CID88929360
Molecular FormulaC11H25NO2
Molecular Weight203.33 g/mol
Exact Mass203.19
IUPAC Name3-(3-methoxy-2,2-dimethylpropoxy)-2,2-dimethylpropan-1-amine
SMILESCOCC(C)(C)COCC(C)(C)CN
InChIInChI=1S/C11H25NO2/c1-10(2,6-12)8-14-9-11(3,4)7-13-5/h6-9,12H2,1-5H3
InChIKeyNVJBRTOZONJTPQ-UHFFFAOYSA-N
XLogP1.66
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(3-amino-2,2-dimethylpropoxy)-2,2-dimethylpropyl]-4-methoxy-3,3-dimethylbutanamide
CID 170012588
3-[3-(2-methoxyethoxy)propoxy]-2,2-dimethylpropan-1-amine
CID 103406340
3-(3-methoxy-2,2-dimethylpropoxy)-2,2-dimethylpropanal
CID 169150505
5-[2-[(3-amino-2,2-dimethylpropoxy)methyl]-3-(4-amino-2,2,4-trimethylpentoxy)-2-[(4-amino-2,2,4-trimethylpentoxy)methyl]propoxy]-2,4,4-trimethylpentan-2-amine
CID 155267878
3-(3-methoxy-3-methylbutoxy)-2,2-dimethylpropan-1-amine
CID 106668062
3-(3-azido-2,2-dimethylpropoxy)-2,2-dimethylpropan-1-amine
CID 173483389
2,2-dimethyl-3-(methylaminooxy)propan-1-amine
CID 155039143
CID 88586173
CID 88586173
5-(3-amino-2,2-dimethylpropoxy)-4,4-dimethylpentanoic acid
CID 169158624
1-(2,2-dimethylpropoxy)-3-[3-[3-(2,2-dimethylpropoxy)-2,2-dimethylpropoxy]-2,2-dimethylpropoxy]-2,2-dimethylpropane
CID 58571431
(2R)-3-methoxy-2-methylpropane-1,2-diamine
CID 94474940
2,2-dimethylpropane-1,3-diamine
CID 162099967

Frequently Asked Questions

What is the IUPAC name of 3-(3-methoxy-2,2-dimethylpropoxy)-2,2-dimethylpropan-1-amine?
The IUPAC name of 3-(3-methoxy-2,2-dimethylpropoxy)-2,2-dimethylpropan-1-amine (CID 88929360) is 3-(3-methoxy-2,2-dimethylpropoxy)-2,2-dimethylpropan-1-amine.
What is the SMILES notation for 3-(3-methoxy-2,2-dimethylpropoxy)-2,2-dimethylpropan-1-amine?
The canonical SMILES for 3-(3-methoxy-2,2-dimethylpropoxy)-2,2-dimethylpropan-1-amine is COCC(C)(C)COCC(C)(C)CN.
What is the InChIKey of 3-(3-methoxy-2,2-dimethylpropoxy)-2,2-dimethylpropan-1-amine?
The InChIKey is NVJBRTOZONJTPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO2/c1-10(2,6-12)8-14-9-11(3,4)7-13-5/h6-9,12H2,1-5H3.
What are the key properties of 3-(3-methoxy-2,2-dimethylpropoxy)-2,2-dimethylpropan-1-amine?
3-(3-methoxy-2,2-dimethylpropoxy)-2,2-dimethylpropan-1-amine has a molecular weight of 203.33 g/mol, XLogP of 1.66, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methoxy-2,2-dimethylpropoxy)-2,2-dimethylpropan-1-amine is sourced from PubChem (CID 88929360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).