N-cyclopentyl-1-methylpiperidin-4-amine;dihydrochloride

C11H24Cl2N2 — CID 53408550

IUPACN-cyclopentyl-1-methylpiperidin-4-amine;dihydrochloride
SMILESCN1CCC(NC2CCCC2)CC1.Cl.Cl
InChIInChI=1S/C11H22N2.2ClH/c1-13-8-6-11(7-9-13)12-10-4-2-3-5-10;;/h10-12H,2-9H2,1H3;2*1H
InChIKeyKCFPIUDGTHEUEE-UHFFFAOYSA-N
MW255.23 g/mol
LogP2.46
Rot. Bonds2

About N-cyclopentyl-1-methylpiperidin-4-amine;dihydrochloride

N-cyclopentyl-1-methylpiperidin-4-amine;dihydrochloride (PubChem CID 53408550) has the molecular formula C11H24Cl2N2 and a molecular weight of 255.23 g/mol. Its IUPAC name is N-cyclopentyl-1-methylpiperidin-4-amine;dihydrochloride.

Molecular Properties

Compound NameN-cyclopentyl-1-methylpiperidin-4-amine;dihydrochloride
PubChem CID53408550
Molecular FormulaC11H24Cl2N2
Molecular Weight255.23 g/mol
Exact Mass254.13
IUPAC NameN-cyclopentyl-1-methylpiperidin-4-amine;dihydrochloride
SMILESCN1CCC(NC2CCCC2)CC1.Cl.Cl
InChIInChI=1S/C11H22N2.2ClH/c1-13-8-6-11(7-9-13)12-10-4-2-3-5-10;;/h10-12H,2-9H2,1H3;2*1H
InChIKeyKCFPIUDGTHEUEE-UHFFFAOYSA-N
XLogP2.46
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.23
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-1-methylpiperidin-4-amine;dihydrochloride?
The IUPAC name of N-cyclopentyl-1-methylpiperidin-4-amine;dihydrochloride (CID 53408550) is N-cyclopentyl-1-methylpiperidin-4-amine;dihydrochloride.
What is the SMILES notation for N-cyclopentyl-1-methylpiperidin-4-amine;dihydrochloride?
The canonical SMILES for N-cyclopentyl-1-methylpiperidin-4-amine;dihydrochloride is CN1CCC(NC2CCCC2)CC1.Cl.Cl.
What is the InChIKey of N-cyclopentyl-1-methylpiperidin-4-amine;dihydrochloride?
The InChIKey is KCFPIUDGTHEUEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2.2ClH/c1-13-8-6-11(7-9-13)12-10-4-2-3-5-10;;/h10-12H,2-9H2,1H3;2*1H.
What are the key properties of N-cyclopentyl-1-methylpiperidin-4-amine;dihydrochloride?
N-cyclopentyl-1-methylpiperidin-4-amine;dihydrochloride has a molecular weight of 255.23 g/mol, XLogP of 2.46, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-1-methylpiperidin-4-amine;dihydrochloride is sourced from PubChem (CID 53408550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).