N-(2-fluorophenyl)-1-propylpiperidin-4-amine

C14H21FN2 — CID 6456393

IUPACN-(2-fluorophenyl)-1-propylpiperidin-4-amine
SMILESCCCN1CCC(Nc2ccccc2F)CC1
InChIInChI=1S/C14H21FN2/c1-2-9-17-10-7-12(8-11-17)16-14-6-4-3-5-13(14)15/h3-6,12,16H,2,7-11H2,1H3
InChIKeyHSRJVAQZDYQSNT-UHFFFAOYSA-N
MW236.33 g/mol
LogP3.11
Rot. Bonds4

About N-(2-fluorophenyl)-1-propylpiperidin-4-amine

N-(2-fluorophenyl)-1-propylpiperidin-4-amine (PubChem CID 6456393) has the molecular formula C14H21FN2 and a molecular weight of 236.33 g/mol. Its IUPAC name is N-(2-fluorophenyl)-1-propylpiperidin-4-amine.

Molecular Properties

Compound NameN-(2-fluorophenyl)-1-propylpiperidin-4-amine
PubChem CID6456393
Molecular FormulaC14H21FN2
Molecular Weight236.33 g/mol
Exact Mass236.17
IUPAC NameN-(2-fluorophenyl)-1-propylpiperidin-4-amine
SMILESCCCN1CCC(Nc2ccccc2F)CC1
InChIInChI=1S/C14H21FN2/c1-2-9-17-10-7-12(8-11-17)16-14-6-4-3-5-13(14)15/h3-6,12,16H,2,7-11H2,1H3
InChIKeyHSRJVAQZDYQSNT-UHFFFAOYSA-N
XLogP3.11
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.33
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-1-propylpiperidin-4-amine?
The IUPAC name of N-(2-fluorophenyl)-1-propylpiperidin-4-amine (CID 6456393) is N-(2-fluorophenyl)-1-propylpiperidin-4-amine.
What is the SMILES notation for N-(2-fluorophenyl)-1-propylpiperidin-4-amine?
The canonical SMILES for N-(2-fluorophenyl)-1-propylpiperidin-4-amine is CCCN1CCC(Nc2ccccc2F)CC1.
What is the InChIKey of N-(2-fluorophenyl)-1-propylpiperidin-4-amine?
The InChIKey is HSRJVAQZDYQSNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21FN2/c1-2-9-17-10-7-12(8-11-17)16-14-6-4-3-5-13(14)15/h3-6,12,16H,2,7-11H2,1H3.
What are the key properties of N-(2-fluorophenyl)-1-propylpiperidin-4-amine?
N-(2-fluorophenyl)-1-propylpiperidin-4-amine has a molecular weight of 236.33 g/mol, XLogP of 3.11, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-1-propylpiperidin-4-amine is sourced from PubChem (CID 6456393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).