N-(3-ethoxycyclobutyl)-1,3-dimethylpiperidin-4-amine

C13H26N2O — CID 115905678

IUPACN-(3-ethoxycyclobutyl)-1,3-dimethylpiperidin-4-amine
SMILESCCOC1CC(NC2CCN(C)CC2C)C1
InChIInChI=1S/C13H26N2O/c1-4-16-12-7-11(8-12)14-13-5-6-15(3)9-10(13)2/h10-14H,4-9H2,1-3H3
InChIKeyAIXIVWYSMPLIMJ-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.48
Rot. Bonds4

About N-(3-ethoxycyclobutyl)-1,3-dimethylpiperidin-4-amine

N-(3-ethoxycyclobutyl)-1,3-dimethylpiperidin-4-amine (PubChem CID 115905678) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is N-(3-ethoxycyclobutyl)-1,3-dimethylpiperidin-4-amine.

Molecular Properties

Compound NameN-(3-ethoxycyclobutyl)-1,3-dimethylpiperidin-4-amine
PubChem CID115905678
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC NameN-(3-ethoxycyclobutyl)-1,3-dimethylpiperidin-4-amine
SMILESCCOC1CC(NC2CCN(C)CC2C)C1
InChIInChI=1S/C13H26N2O/c1-4-16-12-7-11(8-12)14-13-5-6-15(3)9-10(13)2/h10-14H,4-9H2,1-3H3
InChIKeyAIXIVWYSMPLIMJ-UHFFFAOYSA-N
XLogP1.48
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-ethylcyclopentyl)-1,3-dimethylpiperidin-4-amine
CID 115717575
N-(1,3-dimethylpiperidin-4-yl)-8-methyl-8-azabicyclo[3.2.1]octan-3-amine
CID 114503286
N-(4-ethylcyclohexyl)-1,3-dimethylpiperidin-4-amine
CID 115710210
N-(3-ethoxy-2-ethyl-2-methylcyclobutyl)-1,3-dimethylpiperidin-4-amine
CID 114503243
N-(3-ethoxyspiro[3.3]heptan-1-yl)-1,3-dimethylpiperidin-4-amine
CID 115723735
N-(2-ethyloxan-4-yl)-1,3-dimethylpiperidin-4-amine
CID 114503263
N-(1,3-dimethylpiperidin-4-yl)-1,2,5-trimethylpiperidin-4-amine
CID 113261212
1,3-dimethyl-N-(thian-4-yl)piperidin-4-amine
CID 115615447
1,3-dimethyl-N-(2-methylcyclobutyl)piperidin-4-amine
CID 130171575
N-(1-cyclopropyl-5-methylpyrrolidin-3-yl)-1,3-dimethylpiperidin-4-amine
CID 115717633
N-(3-ethoxycyclobutyl)-2,6-dimethylcyclohexan-1-amine
CID 103917407
N-(3-ethoxycyclobutyl)-9-methyl-9-azabicyclo[3.3.1]nonan-3-amine
CID 112554632

Frequently Asked Questions

What is the IUPAC name of N-(3-ethoxycyclobutyl)-1,3-dimethylpiperidin-4-amine?
The IUPAC name of N-(3-ethoxycyclobutyl)-1,3-dimethylpiperidin-4-amine (CID 115905678) is N-(3-ethoxycyclobutyl)-1,3-dimethylpiperidin-4-amine.
What is the SMILES notation for N-(3-ethoxycyclobutyl)-1,3-dimethylpiperidin-4-amine?
The canonical SMILES for N-(3-ethoxycyclobutyl)-1,3-dimethylpiperidin-4-amine is CCOC1CC(NC2CCN(C)CC2C)C1.
What is the InChIKey of N-(3-ethoxycyclobutyl)-1,3-dimethylpiperidin-4-amine?
The InChIKey is AIXIVWYSMPLIMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-4-16-12-7-11(8-12)14-13-5-6-15(3)9-10(13)2/h10-14H,4-9H2,1-3H3.
What are the key properties of N-(3-ethoxycyclobutyl)-1,3-dimethylpiperidin-4-amine?
N-(3-ethoxycyclobutyl)-1,3-dimethylpiperidin-4-amine has a molecular weight of 226.36 g/mol, XLogP of 1.48, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethoxycyclobutyl)-1,3-dimethylpiperidin-4-amine is sourced from PubChem (CID 115905678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).