2-[2-(2,4-dimethylpiperidin-1-yl)ethyl]-N-propylcyclopentan-1-amine

C17H34N2 — CID 79566322

IUPAC2-[2-(2,4-dimethylpiperidin-1-yl)ethyl]-N-propylcyclopentan-1-amine
SMILESCCCNC1CCCC1CCN1CCC(C)CC1C
InChIInChI=1S/C17H34N2/c1-4-10-18-17-7-5-6-16(17)9-12-19-11-8-14(2)13-15(19)3/h14-18H,4-13H2,1-3H3
InChIKeyCYMURSYMWMMQIL-UHFFFAOYSA-N
MW266.47 g/mol
LogP3.67
Rot. Bonds6

About 2-[2-(2,4-dimethylpiperidin-1-yl)ethyl]-N-propylcyclopentan-1-amine

2-[2-(2,4-dimethylpiperidin-1-yl)ethyl]-N-propylcyclopentan-1-amine (PubChem CID 79566322) has the molecular formula C17H34N2 and a molecular weight of 266.47 g/mol. Its IUPAC name is 2-[2-(2,4-dimethylpiperidin-1-yl)ethyl]-N-propylcyclopentan-1-amine.

Molecular Properties

Compound Name2-[2-(2,4-dimethylpiperidin-1-yl)ethyl]-N-propylcyclopentan-1-amine
PubChem CID79566322
Molecular FormulaC17H34N2
Molecular Weight266.47 g/mol
Exact Mass266.27
IUPAC Name2-[2-(2,4-dimethylpiperidin-1-yl)ethyl]-N-propylcyclopentan-1-amine
SMILESCCCNC1CCCC1CCN1CCC(C)CC1C
InChIInChI=1S/C17H34N2/c1-4-10-18-17-7-5-6-16(17)9-12-19-11-8-14(2)13-15(19)3/h14-18H,4-13H2,1-3H3
InChIKeyCYMURSYMWMMQIL-UHFFFAOYSA-N
XLogP3.67
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.47
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(2,4-dimethylpiperidin-1-yl)ethyl]-N-propylcyclopentan-1-amine?
The IUPAC name of 2-[2-(2,4-dimethylpiperidin-1-yl)ethyl]-N-propylcyclopentan-1-amine (CID 79566322) is 2-[2-(2,4-dimethylpiperidin-1-yl)ethyl]-N-propylcyclopentan-1-amine.
What is the SMILES notation for 2-[2-(2,4-dimethylpiperidin-1-yl)ethyl]-N-propylcyclopentan-1-amine?
The canonical SMILES for 2-[2-(2,4-dimethylpiperidin-1-yl)ethyl]-N-propylcyclopentan-1-amine is CCCNC1CCCC1CCN1CCC(C)CC1C.
What is the InChIKey of 2-[2-(2,4-dimethylpiperidin-1-yl)ethyl]-N-propylcyclopentan-1-amine?
The InChIKey is CYMURSYMWMMQIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2/c1-4-10-18-17-7-5-6-16(17)9-12-19-11-8-14(2)13-15(19)3/h14-18H,4-13H2,1-3H3.
What are the key properties of 2-[2-(2,4-dimethylpiperidin-1-yl)ethyl]-N-propylcyclopentan-1-amine?
2-[2-(2,4-dimethylpiperidin-1-yl)ethyl]-N-propylcyclopentan-1-amine has a molecular weight of 266.47 g/mol, XLogP of 3.67, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2,4-dimethylpiperidin-1-yl)ethyl]-N-propylcyclopentan-1-amine is sourced from PubChem (CID 79566322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).