1-(2-ethoxy-2-methylpropyl)-N-ethylpiperidin-3-amine

C13H28N2O — CID 114944306

IUPAC1-(2-ethoxy-2-methylpropyl)-N-ethylpiperidin-3-amine
SMILESCCNC1CCCN(CC(C)(C)OCC)C1
InChIInChI=1S/C13H28N2O/c1-5-14-12-8-7-9-15(10-12)11-13(3,4)16-6-2/h12,14H,5-11H2,1-4H3
InChIKeyGNTCKPGBGOTANQ-UHFFFAOYSA-N
MW228.38 g/mol
LogP1.88
Rot. Bonds6

About 1-(2-ethoxy-2-methylpropyl)-N-ethylpiperidin-3-amine

1-(2-ethoxy-2-methylpropyl)-N-ethylpiperidin-3-amine (PubChem CID 114944306) has the molecular formula C13H28N2O and a molecular weight of 228.38 g/mol. Its IUPAC name is 1-(2-ethoxy-2-methylpropyl)-N-ethylpiperidin-3-amine.

Molecular Properties

Compound Name1-(2-ethoxy-2-methylpropyl)-N-ethylpiperidin-3-amine
PubChem CID114944306
Molecular FormulaC13H28N2O
Molecular Weight228.38 g/mol
Exact Mass228.22
IUPAC Name1-(2-ethoxy-2-methylpropyl)-N-ethylpiperidin-3-amine
SMILESCCNC1CCCN(CC(C)(C)OCC)C1
InChIInChI=1S/C13H28N2O/c1-5-14-12-8-7-9-15(10-12)11-13(3,4)16-6-2/h12,14H,5-11H2,1-4H3
InChIKeyGNTCKPGBGOTANQ-UHFFFAOYSA-N
XLogP1.88
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.38
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-ethoxy-2-methylpropyl)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine
CID 114944355
N-cyclopropyl-1-(2-methoxy-2-methylpropyl)piperidin-3-amine
CID 104766166
ethyl 2-[3-(ethylamino)piperidin-1-yl]acetate
CID 83990671
N-ethyl-1-(2,2,2-trifluoroethyl)pyrrolidin-3-amine;dihydrochloride
CID 122156751
1-(2-ethoxy-2-methylpropyl)-3-propan-2-yl-1,4-diazepane
CID 114944367
N-ethyl-1-(3-ethylpentan-3-yl)piperidin-3-amine
CID 65043436
1-(3-methoxy-2,2-dimethylpropyl)-N-methylpiperidin-3-amine
CID 120838017
N-ethyl-1-[2-(1,2,4-oxadiazol-5-yl)ethyl]piperidin-3-amine
CID 106408371
N-ethyl-1-(2-methoxy-2-methylpropyl)-3-methylpiperidin-4-amine
CID 104761939
1-[(3,3-difluorocyclohexyl)methyl]-N-ethylpiperidin-3-amine
CID 114223582
N-(2,2-dimethylpropyl)-1-(2-methoxyethyl)piperidin-3-amine;hydrochloride
CID 115616373
N-ethyl-1-(2-pyrrolidin-1-ylethyl)piperidin-4-amine
CID 107910858

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethoxy-2-methylpropyl)-N-ethylpiperidin-3-amine?
The IUPAC name of 1-(2-ethoxy-2-methylpropyl)-N-ethylpiperidin-3-amine (CID 114944306) is 1-(2-ethoxy-2-methylpropyl)-N-ethylpiperidin-3-amine.
What is the SMILES notation for 1-(2-ethoxy-2-methylpropyl)-N-ethylpiperidin-3-amine?
The canonical SMILES for 1-(2-ethoxy-2-methylpropyl)-N-ethylpiperidin-3-amine is CCNC1CCCN(CC(C)(C)OCC)C1.
What is the InChIKey of 1-(2-ethoxy-2-methylpropyl)-N-ethylpiperidin-3-amine?
The InChIKey is GNTCKPGBGOTANQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O/c1-5-14-12-8-7-9-15(10-12)11-13(3,4)16-6-2/h12,14H,5-11H2,1-4H3.
What are the key properties of 1-(2-ethoxy-2-methylpropyl)-N-ethylpiperidin-3-amine?
1-(2-ethoxy-2-methylpropyl)-N-ethylpiperidin-3-amine has a molecular weight of 228.38 g/mol, XLogP of 1.88, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethoxy-2-methylpropyl)-N-ethylpiperidin-3-amine is sourced from PubChem (CID 114944306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).