1-cyclopentyl-N,N-dimethyl-2-piperidin-4-ylethanamine

C14H28N2 — CID 116906903

IUPAC1-cyclopentyl-N,N-dimethyl-2-piperidin-4-ylethanamine
SMILESCN(C)C(CC1CCNCC1)C1CCCC1
InChIInChI=1S/C14H28N2/c1-16(2)14(13-5-3-4-6-13)11-12-7-9-15-10-8-12/h12-15H,3-11H2,1-2H3
InChIKeyXPRGLICXPPMELK-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.50
Rot. Bonds4

About 1-cyclopentyl-N,N-dimethyl-2-piperidin-4-ylethanamine

1-cyclopentyl-N,N-dimethyl-2-piperidin-4-ylethanamine (PubChem CID 116906903) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is 1-cyclopentyl-N,N-dimethyl-2-piperidin-4-ylethanamine.

Molecular Properties

Compound Name1-cyclopentyl-N,N-dimethyl-2-piperidin-4-ylethanamine
PubChem CID116906903
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC Name1-cyclopentyl-N,N-dimethyl-2-piperidin-4-ylethanamine
SMILESCN(C)C(CC1CCNCC1)C1CCCC1
InChIInChI=1S/C14H28N2/c1-16(2)14(13-5-3-4-6-13)11-12-7-9-15-10-8-12/h12-15H,3-11H2,1-2H3
InChIKeyXPRGLICXPPMELK-UHFFFAOYSA-N
XLogP2.50
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-N,N-dimethyl-2-piperidin-4-ylethanamine?
The IUPAC name of 1-cyclopentyl-N,N-dimethyl-2-piperidin-4-ylethanamine (CID 116906903) is 1-cyclopentyl-N,N-dimethyl-2-piperidin-4-ylethanamine.
What is the SMILES notation for 1-cyclopentyl-N,N-dimethyl-2-piperidin-4-ylethanamine?
The canonical SMILES for 1-cyclopentyl-N,N-dimethyl-2-piperidin-4-ylethanamine is CN(C)C(CC1CCNCC1)C1CCCC1.
What is the InChIKey of 1-cyclopentyl-N,N-dimethyl-2-piperidin-4-ylethanamine?
The InChIKey is XPRGLICXPPMELK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-16(2)14(13-5-3-4-6-13)11-12-7-9-15-10-8-12/h12-15H,3-11H2,1-2H3.
What are the key properties of 1-cyclopentyl-N,N-dimethyl-2-piperidin-4-ylethanamine?
1-cyclopentyl-N,N-dimethyl-2-piperidin-4-ylethanamine has a molecular weight of 224.39 g/mol, XLogP of 2.50, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-N,N-dimethyl-2-piperidin-4-ylethanamine is sourced from PubChem (CID 116906903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).