N,1-dicyclopropyl-5-phenylpiperidin-3-amine

C17H24N2 — CID 83991790

IUPACN,1-dicyclopropyl-5-phenylpiperidin-3-amine
SMILESc1ccc(C2CC(NC3CC3)CN(C3CC3)C2)cc1
InChIInChI=1S/C17H24N2/c1-2-4-13(5-3-1)14-10-16(18-15-6-7-15)12-19(11-14)17-8-9-17/h1-5,14-18H,6-12H2
InChIKeyJEPLHGDMGQCPDK-UHFFFAOYSA-N
MW256.39 g/mol
LogP2.76
Rot. Bonds4

About N,1-dicyclopropyl-5-phenylpiperidin-3-amine

N,1-dicyclopropyl-5-phenylpiperidin-3-amine (PubChem CID 83991790) has the molecular formula C17H24N2 and a molecular weight of 256.39 g/mol. Its IUPAC name is N,1-dicyclopropyl-5-phenylpiperidin-3-amine.

Molecular Properties

Compound NameN,1-dicyclopropyl-5-phenylpiperidin-3-amine
PubChem CID83991790
Molecular FormulaC17H24N2
Molecular Weight256.39 g/mol
Exact Mass256.19
IUPAC NameN,1-dicyclopropyl-5-phenylpiperidin-3-amine
SMILESc1ccc(C2CC(NC3CC3)CN(C3CC3)C2)cc1
InChIInChI=1S/C17H24N2/c1-2-4-13(5-3-1)14-10-16(18-15-6-7-15)12-19(11-14)17-8-9-17/h1-5,14-18H,6-12H2
InChIKeyJEPLHGDMGQCPDK-UHFFFAOYSA-N
XLogP2.76
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,1-dicyclopropyl-5-phenylpiperidin-3-amine?
The IUPAC name of N,1-dicyclopropyl-5-phenylpiperidin-3-amine (CID 83991790) is N,1-dicyclopropyl-5-phenylpiperidin-3-amine.
What is the SMILES notation for N,1-dicyclopropyl-5-phenylpiperidin-3-amine?
The canonical SMILES for N,1-dicyclopropyl-5-phenylpiperidin-3-amine is c1ccc(C2CC(NC3CC3)CN(C3CC3)C2)cc1.
What is the InChIKey of N,1-dicyclopropyl-5-phenylpiperidin-3-amine?
The InChIKey is JEPLHGDMGQCPDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2/c1-2-4-13(5-3-1)14-10-16(18-15-6-7-15)12-19(11-14)17-8-9-17/h1-5,14-18H,6-12H2.
What are the key properties of N,1-dicyclopropyl-5-phenylpiperidin-3-amine?
N,1-dicyclopropyl-5-phenylpiperidin-3-amine has a molecular weight of 256.39 g/mol, XLogP of 2.76, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-dicyclopropyl-5-phenylpiperidin-3-amine is sourced from PubChem (CID 83991790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).