N-phenyl-1-[1-(2-phenylethyl)piperidin-4-yl]piperidin-4-amine

C24H33N3 — CID 156588928

IUPACN-phenyl-1-[1-(2-phenylethyl)piperidin-4-yl]piperidin-4-amine
SMILESc1ccc(CCN2CCC(N3CCC(Nc4ccccc4)CC3)CC2)cc1
InChIInChI=1S/C24H33N3/c1-3-7-21(8-4-1)11-16-26-17-14-24(15-18-26)27-19-12-23(13-20-27)25-22-9-5-2-6-10-22/h1-10,23-25H,11-20H2
InChIKeyWAXLNNINXFRTDA-UHFFFAOYSA-N
MW363.55 g/mol
LogP4.27
Rot. Bonds6

About N-phenyl-1-[1-(2-phenylethyl)piperidin-4-yl]piperidin-4-amine

N-phenyl-1-[1-(2-phenylethyl)piperidin-4-yl]piperidin-4-amine (PubChem CID 156588928) has the molecular formula C24H33N3 and a molecular weight of 363.55 g/mol. Its IUPAC name is N-phenyl-1-[1-(2-phenylethyl)piperidin-4-yl]piperidin-4-amine.

Molecular Properties

Compound NameN-phenyl-1-[1-(2-phenylethyl)piperidin-4-yl]piperidin-4-amine
PubChem CID156588928
Molecular FormulaC24H33N3
Molecular Weight363.55 g/mol
Exact Mass363.27
IUPAC NameN-phenyl-1-[1-(2-phenylethyl)piperidin-4-yl]piperidin-4-amine
SMILESc1ccc(CCN2CCC(N3CCC(Nc4ccccc4)CC3)CC2)cc1
InChIInChI=1S/C24H33N3/c1-3-7-21(8-4-1)11-16-26-17-14-24(15-18-26)27-19-12-23(13-20-27)25-22-9-5-2-6-10-22/h1-10,23-25H,11-20H2
InChIKeyWAXLNNINXFRTDA-UHFFFAOYSA-N
XLogP4.27
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.55
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-phenyl-1-[1-(2-phenylethyl)piperidin-4-yl]piperidin-4-amine?
The IUPAC name of N-phenyl-1-[1-(2-phenylethyl)piperidin-4-yl]piperidin-4-amine (CID 156588928) is N-phenyl-1-[1-(2-phenylethyl)piperidin-4-yl]piperidin-4-amine.
What is the SMILES notation for N-phenyl-1-[1-(2-phenylethyl)piperidin-4-yl]piperidin-4-amine?
The canonical SMILES for N-phenyl-1-[1-(2-phenylethyl)piperidin-4-yl]piperidin-4-amine is c1ccc(CCN2CCC(N3CCC(Nc4ccccc4)CC3)CC2)cc1.
What is the InChIKey of N-phenyl-1-[1-(2-phenylethyl)piperidin-4-yl]piperidin-4-amine?
The InChIKey is WAXLNNINXFRTDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H33N3/c1-3-7-21(8-4-1)11-16-26-17-14-24(15-18-26)27-19-12-23(13-20-27)25-22-9-5-2-6-10-22/h1-10,23-25H,11-20H2.
What are the key properties of N-phenyl-1-[1-(2-phenylethyl)piperidin-4-yl]piperidin-4-amine?
N-phenyl-1-[1-(2-phenylethyl)piperidin-4-yl]piperidin-4-amine has a molecular weight of 363.55 g/mol, XLogP of 4.27, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-1-[1-(2-phenylethyl)piperidin-4-yl]piperidin-4-amine is sourced from PubChem (CID 156588928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).