1-(3-methoxy-2,2-dimethylpropyl)-N-methylpiperidin-3-amine

C12H26N2O — CID 120838017

IUPAC1-(3-methoxy-2,2-dimethylpropyl)-N-methylpiperidin-3-amine
SMILESCNC1CCCN(CC(C)(C)COC)C1
InChIInChI=1S/C12H26N2O/c1-12(2,10-15-4)9-14-7-5-6-11(8-14)13-3/h11,13H,5-10H2,1-4H3
InChIKeyQAZCTXJBCLANCQ-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.34
Rot. Bonds5

About 1-(3-methoxy-2,2-dimethylpropyl)-N-methylpiperidin-3-amine

1-(3-methoxy-2,2-dimethylpropyl)-N-methylpiperidin-3-amine (PubChem CID 120838017) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is 1-(3-methoxy-2,2-dimethylpropyl)-N-methylpiperidin-3-amine.

Molecular Properties

Compound Name1-(3-methoxy-2,2-dimethylpropyl)-N-methylpiperidin-3-amine
PubChem CID120838017
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name1-(3-methoxy-2,2-dimethylpropyl)-N-methylpiperidin-3-amine
SMILESCNC1CCCN(CC(C)(C)COC)C1
InChIInChI=1S/C12H26N2O/c1-12(2,10-15-4)9-14-7-5-6-11(8-14)13-3/h11,13H,5-10H2,1-4H3
InChIKeyQAZCTXJBCLANCQ-UHFFFAOYSA-N
XLogP1.34
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-1-(2-methoxy-2-methylpropyl)piperidin-3-amine
CID 104766166
1-(iodomethyl)-N-methylpiperidin-3-amine
CID 89092988
2-[1-(3-methoxy-2,2-dimethylpropyl)piperidin-4-yl]-N-methylethanamine;hydrochloride
CID 120843554
methyl 2,2-dimethyl-4-[3-(methylamino)piperidin-1-yl]butanoate;hydrochloride
CID 120837971
tert-butyl 2-[3-(methylamino)piperidin-1-yl]acetate
CID 55138302
1-(3-methoxy-2,2-dimethylpropyl)-3-methylpiperazine;hydrochloride
CID 120840258
1-[1-(3-methoxy-2,2-dimethylpropyl)piperidin-3-yl]piperazin-2-one
CID 120844635
N-(2,2-dimethylpropyl)-1-(2-methoxyethyl)piperidin-3-amine;hydrochloride
CID 115616373
[1-(3-methoxy-2,2-dimethylpropyl)piperidin-4-yl]methanamine
CID 22236505
N-[2,2-dimethyl-3-(3-methylpiperidin-1-yl)propyl]cyclopropanamine
CID 62263551
3-[3-(methoxymethyl)piperidin-1-yl]-2,2-dimethylpropan-1-amine
CID 106587324
1-butyl-N-methylpiperidin-3-amine
CID 62534430

Frequently Asked Questions

What is the IUPAC name of 1-(3-methoxy-2,2-dimethylpropyl)-N-methylpiperidin-3-amine?
The IUPAC name of 1-(3-methoxy-2,2-dimethylpropyl)-N-methylpiperidin-3-amine (CID 120838017) is 1-(3-methoxy-2,2-dimethylpropyl)-N-methylpiperidin-3-amine.
What is the SMILES notation for 1-(3-methoxy-2,2-dimethylpropyl)-N-methylpiperidin-3-amine?
The canonical SMILES for 1-(3-methoxy-2,2-dimethylpropyl)-N-methylpiperidin-3-amine is CNC1CCCN(CC(C)(C)COC)C1.
What is the InChIKey of 1-(3-methoxy-2,2-dimethylpropyl)-N-methylpiperidin-3-amine?
The InChIKey is QAZCTXJBCLANCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-12(2,10-15-4)9-14-7-5-6-11(8-14)13-3/h11,13H,5-10H2,1-4H3.
What are the key properties of 1-(3-methoxy-2,2-dimethylpropyl)-N-methylpiperidin-3-amine?
1-(3-methoxy-2,2-dimethylpropyl)-N-methylpiperidin-3-amine has a molecular weight of 214.35 g/mol, XLogP of 1.34, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methoxy-2,2-dimethylpropyl)-N-methylpiperidin-3-amine is sourced from PubChem (CID 120838017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).