N-(3-fluorophenyl)-1-(2-phenylethyl)piperidin-4-amine

C19H23FN2 — CID 23741730

IUPACN-(3-fluorophenyl)-1-(2-phenylethyl)piperidin-4-amine
SMILESFc1cccc(NC2CCN(CCc3ccccc3)CC2)c1
InChIInChI=1S/C19H23FN2/c20-17-7-4-8-19(15-17)21-18-10-13-22(14-11-18)12-9-16-5-2-1-3-6-16/h1-8,15,18,21H,9-14H2
InChIKeyNDGQTNDWAZPEQV-UHFFFAOYSA-N
MW298.41 g/mol
LogP3.94
Rot. Bonds5

About N-(3-fluorophenyl)-1-(2-phenylethyl)piperidin-4-amine

N-(3-fluorophenyl)-1-(2-phenylethyl)piperidin-4-amine (PubChem CID 23741730) has the molecular formula C19H23FN2 and a molecular weight of 298.41 g/mol. Its IUPAC name is N-(3-fluorophenyl)-1-(2-phenylethyl)piperidin-4-amine.

Molecular Properties

Compound NameN-(3-fluorophenyl)-1-(2-phenylethyl)piperidin-4-amine
PubChem CID23741730
Molecular FormulaC19H23FN2
Molecular Weight298.41 g/mol
Exact Mass298.18
IUPAC NameN-(3-fluorophenyl)-1-(2-phenylethyl)piperidin-4-amine
SMILESFc1cccc(NC2CCN(CCc3ccccc3)CC2)c1
InChIInChI=1S/C19H23FN2/c20-17-7-4-8-19(15-17)21-18-10-13-22(14-11-18)12-9-16-5-2-1-3-6-16/h1-8,15,18,21H,9-14H2
InChIKeyNDGQTNDWAZPEQV-UHFFFAOYSA-N
XLogP3.94
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.41
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-1-(2-phenylethyl)piperidin-4-amine?
The IUPAC name of N-(3-fluorophenyl)-1-(2-phenylethyl)piperidin-4-amine (CID 23741730) is N-(3-fluorophenyl)-1-(2-phenylethyl)piperidin-4-amine.
What is the SMILES notation for N-(3-fluorophenyl)-1-(2-phenylethyl)piperidin-4-amine?
The canonical SMILES for N-(3-fluorophenyl)-1-(2-phenylethyl)piperidin-4-amine is Fc1cccc(NC2CCN(CCc3ccccc3)CC2)c1.
What is the InChIKey of N-(3-fluorophenyl)-1-(2-phenylethyl)piperidin-4-amine?
The InChIKey is NDGQTNDWAZPEQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23FN2/c20-17-7-4-8-19(15-17)21-18-10-13-22(14-11-18)12-9-16-5-2-1-3-6-16/h1-8,15,18,21H,9-14H2.
What are the key properties of N-(3-fluorophenyl)-1-(2-phenylethyl)piperidin-4-amine?
N-(3-fluorophenyl)-1-(2-phenylethyl)piperidin-4-amine has a molecular weight of 298.41 g/mol, XLogP of 3.94, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorophenyl)-1-(2-phenylethyl)piperidin-4-amine is sourced from PubChem (CID 23741730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).