N-cyclopentyl-1-(2-methoxyethyl)piperidin-3-amine;hydrochloride

C13H27ClN2O — CID 115616375

IUPACN-cyclopentyl-1-(2-methoxyethyl)piperidin-3-amine;hydrochloride
SMILESCOCCN1CCCC(NC2CCCC2)C1.Cl
InChIInChI=1S/C13H26N2O.ClH/c1-16-10-9-15-8-4-7-13(11-15)14-12-5-2-3-6-12;/h12-14H,2-11H2,1H3;1H
InChIKeyAQSIFBAMOUXSKN-UHFFFAOYSA-N
MW262.82 g/mol
LogP2.05
Rot. Bonds5

About N-cyclopentyl-1-(2-methoxyethyl)piperidin-3-amine;hydrochloride

N-cyclopentyl-1-(2-methoxyethyl)piperidin-3-amine;hydrochloride (PubChem CID 115616375) has the molecular formula C13H27ClN2O and a molecular weight of 262.82 g/mol. Its IUPAC name is N-cyclopentyl-1-(2-methoxyethyl)piperidin-3-amine;hydrochloride.

Molecular Properties

Compound NameN-cyclopentyl-1-(2-methoxyethyl)piperidin-3-amine;hydrochloride
PubChem CID115616375
Molecular FormulaC13H27ClN2O
Molecular Weight262.82 g/mol
Exact Mass262.18
IUPAC NameN-cyclopentyl-1-(2-methoxyethyl)piperidin-3-amine;hydrochloride
SMILESCOCCN1CCCC(NC2CCCC2)C1.Cl
InChIInChI=1S/C13H26N2O.ClH/c1-16-10-9-15-8-4-7-13(11-15)14-12-5-2-3-6-12;/h12-14H,2-11H2,1H3;1H
InChIKeyAQSIFBAMOUXSKN-UHFFFAOYSA-N
XLogP2.05
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.82
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-1-(2-methoxyethyl)piperidin-3-amine;hydrochloride?
The IUPAC name of N-cyclopentyl-1-(2-methoxyethyl)piperidin-3-amine;hydrochloride (CID 115616375) is N-cyclopentyl-1-(2-methoxyethyl)piperidin-3-amine;hydrochloride.
What is the SMILES notation for N-cyclopentyl-1-(2-methoxyethyl)piperidin-3-amine;hydrochloride?
The canonical SMILES for N-cyclopentyl-1-(2-methoxyethyl)piperidin-3-amine;hydrochloride is COCCN1CCCC(NC2CCCC2)C1.Cl.
What is the InChIKey of N-cyclopentyl-1-(2-methoxyethyl)piperidin-3-amine;hydrochloride?
The InChIKey is AQSIFBAMOUXSKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O.ClH/c1-16-10-9-15-8-4-7-13(11-15)14-12-5-2-3-6-12;/h12-14H,2-11H2,1H3;1H.
What are the key properties of N-cyclopentyl-1-(2-methoxyethyl)piperidin-3-amine;hydrochloride?
N-cyclopentyl-1-(2-methoxyethyl)piperidin-3-amine;hydrochloride has a molecular weight of 262.82 g/mol, XLogP of 2.05, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-1-(2-methoxyethyl)piperidin-3-amine;hydrochloride is sourced from PubChem (CID 115616375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).