1-(2-cyclopentyloxyethyl)-3-methyl-N-propylpiperidin-4-amine

C16H32N2O — CID 63828595

IUPAC1-(2-cyclopentyloxyethyl)-3-methyl-N-propylpiperidin-4-amine
SMILESCCCNC1CCN(CCOC2CCCC2)CC1C
InChIInChI=1S/C16H32N2O/c1-3-9-17-16-8-10-18(13-14(16)2)11-12-19-15-6-4-5-7-15/h14-17H,3-13H2,1-2H3
InChIKeyJPVIPPHHXNACTR-UHFFFAOYSA-N
MW268.44 g/mol
LogP2.66
Rot. Bonds7

About 1-(2-cyclopentyloxyethyl)-3-methyl-N-propylpiperidin-4-amine

1-(2-cyclopentyloxyethyl)-3-methyl-N-propylpiperidin-4-amine (PubChem CID 63828595) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is 1-(2-cyclopentyloxyethyl)-3-methyl-N-propylpiperidin-4-amine.

Molecular Properties

Compound Name1-(2-cyclopentyloxyethyl)-3-methyl-N-propylpiperidin-4-amine
PubChem CID63828595
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC Name1-(2-cyclopentyloxyethyl)-3-methyl-N-propylpiperidin-4-amine
SMILESCCCNC1CCN(CCOC2CCCC2)CC1C
InChIInChI=1S/C16H32N2O/c1-3-9-17-16-8-10-18(13-14(16)2)11-12-19-15-6-4-5-7-15/h14-17H,3-13H2,1-2H3
InChIKeyJPVIPPHHXNACTR-UHFFFAOYSA-N
XLogP2.66
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclopentyloxyethyl)-3-methyl-N-propylpiperidin-4-amine?
The IUPAC name of 1-(2-cyclopentyloxyethyl)-3-methyl-N-propylpiperidin-4-amine (CID 63828595) is 1-(2-cyclopentyloxyethyl)-3-methyl-N-propylpiperidin-4-amine.
What is the SMILES notation for 1-(2-cyclopentyloxyethyl)-3-methyl-N-propylpiperidin-4-amine?
The canonical SMILES for 1-(2-cyclopentyloxyethyl)-3-methyl-N-propylpiperidin-4-amine is CCCNC1CCN(CCOC2CCCC2)CC1C.
What is the InChIKey of 1-(2-cyclopentyloxyethyl)-3-methyl-N-propylpiperidin-4-amine?
The InChIKey is JPVIPPHHXNACTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-3-9-17-16-8-10-18(13-14(16)2)11-12-19-15-6-4-5-7-15/h14-17H,3-13H2,1-2H3.
What are the key properties of 1-(2-cyclopentyloxyethyl)-3-methyl-N-propylpiperidin-4-amine?
1-(2-cyclopentyloxyethyl)-3-methyl-N-propylpiperidin-4-amine has a molecular weight of 268.44 g/mol, XLogP of 2.66, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclopentyloxyethyl)-3-methyl-N-propylpiperidin-4-amine is sourced from PubChem (CID 63828595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).