5-(2,5-dimethylpiperidin-1-yl)-N-ethyl-2,2-dimethylcyclopentan-1-amine

C16H32N2 — CID 79860662

IUPAC5-(2,5-dimethylpiperidin-1-yl)-N-ethyl-2,2-dimethylcyclopentan-1-amine
SMILESCCNC1C(N2CC(C)CCC2C)CCC1(C)C
InChIInChI=1S/C16H32N2/c1-6-17-15-14(9-10-16(15,4)5)18-11-12(2)7-8-13(18)3/h12-15,17H,6-11H2,1-5H3
InChIKeyDNDZKVHKNLBUED-UHFFFAOYSA-N
MW252.45 g/mol
LogP3.27
Rot. Bonds3

About 5-(2,5-dimethylpiperidin-1-yl)-N-ethyl-2,2-dimethylcyclopentan-1-amine

5-(2,5-dimethylpiperidin-1-yl)-N-ethyl-2,2-dimethylcyclopentan-1-amine (PubChem CID 79860662) has the molecular formula C16H32N2 and a molecular weight of 252.45 g/mol. Its IUPAC name is 5-(2,5-dimethylpiperidin-1-yl)-N-ethyl-2,2-dimethylcyclopentan-1-amine.

Molecular Properties

Compound Name5-(2,5-dimethylpiperidin-1-yl)-N-ethyl-2,2-dimethylcyclopentan-1-amine
PubChem CID79860662
Molecular FormulaC16H32N2
Molecular Weight252.45 g/mol
Exact Mass252.26
IUPAC Name5-(2,5-dimethylpiperidin-1-yl)-N-ethyl-2,2-dimethylcyclopentan-1-amine
SMILESCCNC1C(N2CC(C)CCC2C)CCC1(C)C
InChIInChI=1S/C16H32N2/c1-6-17-15-14(9-10-16(15,4)5)18-11-12(2)7-8-13(18)3/h12-15,17H,6-11H2,1-5H3
InChIKeyDNDZKVHKNLBUED-UHFFFAOYSA-N
XLogP3.27
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.45
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(2,5-dimethylpiperidin-1-yl)-N-ethyl-2,2-dimethylcyclopentan-1-amine?
The IUPAC name of 5-(2,5-dimethylpiperidin-1-yl)-N-ethyl-2,2-dimethylcyclopentan-1-amine (CID 79860662) is 5-(2,5-dimethylpiperidin-1-yl)-N-ethyl-2,2-dimethylcyclopentan-1-amine.
What is the SMILES notation for 5-(2,5-dimethylpiperidin-1-yl)-N-ethyl-2,2-dimethylcyclopentan-1-amine?
The canonical SMILES for 5-(2,5-dimethylpiperidin-1-yl)-N-ethyl-2,2-dimethylcyclopentan-1-amine is CCNC1C(N2CC(C)CCC2C)CCC1(C)C.
What is the InChIKey of 5-(2,5-dimethylpiperidin-1-yl)-N-ethyl-2,2-dimethylcyclopentan-1-amine?
The InChIKey is DNDZKVHKNLBUED-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2/c1-6-17-15-14(9-10-16(15,4)5)18-11-12(2)7-8-13(18)3/h12-15,17H,6-11H2,1-5H3.
What are the key properties of 5-(2,5-dimethylpiperidin-1-yl)-N-ethyl-2,2-dimethylcyclopentan-1-amine?
5-(2,5-dimethylpiperidin-1-yl)-N-ethyl-2,2-dimethylcyclopentan-1-amine has a molecular weight of 252.45 g/mol, XLogP of 3.27, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,5-dimethylpiperidin-1-yl)-N-ethyl-2,2-dimethylcyclopentan-1-amine is sourced from PubChem (CID 79860662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).