N-(2-phenylethyl)-1-pyridin-2-ylpiperidin-4-amine

C18H23N3 — CID 43675384

IUPACN-(2-phenylethyl)-1-pyridin-2-ylpiperidin-4-amine
SMILESc1ccc(CCNC2CCN(c3ccccn3)CC2)cc1
InChIInChI=1S/C18H23N3/c1-2-6-16(7-3-1)9-13-19-17-10-14-21(15-11-17)18-8-4-5-12-20-18/h1-8,12,17,19H,9-11,13-15H2
InChIKeyRMLAVXUMTOXGPQ-UHFFFAOYSA-N
MW281.40 g/mol
LogP2.88
Rot. Bonds5

About N-(2-phenylethyl)-1-pyridin-2-ylpiperidin-4-amine

N-(2-phenylethyl)-1-pyridin-2-ylpiperidin-4-amine (PubChem CID 43675384) has the molecular formula C18H23N3 and a molecular weight of 281.40 g/mol. Its IUPAC name is N-(2-phenylethyl)-1-pyridin-2-ylpiperidin-4-amine.

Molecular Properties

Compound NameN-(2-phenylethyl)-1-pyridin-2-ylpiperidin-4-amine
PubChem CID43675384
Molecular FormulaC18H23N3
Molecular Weight281.40 g/mol
Exact Mass281.19
IUPAC NameN-(2-phenylethyl)-1-pyridin-2-ylpiperidin-4-amine
SMILESc1ccc(CCNC2CCN(c3ccccn3)CC2)cc1
InChIInChI=1S/C18H23N3/c1-2-6-16(7-3-1)9-13-19-17-10-14-21(15-11-17)18-8-4-5-12-20-18/h1-8,12,17,19H,9-11,13-15H2
InChIKeyRMLAVXUMTOXGPQ-UHFFFAOYSA-N
XLogP2.88
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(2-phenylethyl)-1-pyridin-2-ylpiperidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-pyridin-2-yl-N-(2-pyridin-2-ylethyl)piperidin-4-amine
CID 43761318
N-methyl-3-[2-[(1-pyridin-2-ylpiperidin-4-yl)amino]ethyl]benzamide
CID 75428282
N-(2-methylsulfanylethyl)-1-pyridin-2-ylpiperidin-4-amine
CID 63983974
N-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]-1-pyridin-2-ylpiperidin-4-amine
CID 63332224
N',N'-diethyl-N-(1-pyridin-2-ylpiperidin-4-yl)ethane-1,2-diamine
CID 43761755
2-[(1-pyridin-2-ylpiperidin-4-yl)amino]ethylurea
CID 83111405
N-(3-methylsulfanylpropyl)-1-pyridin-2-ylpiperidin-4-amine
CID 43675357
1-(2-phenylethyl)-3-(1-pyridin-2-ylpyrrolidin-3-yl)urea
CID 90621427
N-[2-[(1-pyridin-2-ylpiperidin-4-yl)amino]ethyl]cyclopropanecarboxamide
CID 115706396
N-(5-methylhexyl)-1-pyridin-2-ylpiperidin-4-amine
CID 81338605
N-[(4-ethylphenyl)methyl]-1-pyridin-2-ylpiperidin-4-amine
CID 119126767
N-(3-methoxy-3-methylbutyl)-1-pyridin-2-ylpiperidin-4-amine
CID 106675135

Frequently Asked Questions

What is the IUPAC name of N-(2-phenylethyl)-1-pyridin-2-ylpiperidin-4-amine?
The IUPAC name of N-(2-phenylethyl)-1-pyridin-2-ylpiperidin-4-amine (CID 43675384) is N-(2-phenylethyl)-1-pyridin-2-ylpiperidin-4-amine.
What is the SMILES notation for N-(2-phenylethyl)-1-pyridin-2-ylpiperidin-4-amine?
The canonical SMILES for N-(2-phenylethyl)-1-pyridin-2-ylpiperidin-4-amine is c1ccc(CCNC2CCN(c3ccccn3)CC2)cc1.
What is the InChIKey of N-(2-phenylethyl)-1-pyridin-2-ylpiperidin-4-amine?
The InChIKey is RMLAVXUMTOXGPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3/c1-2-6-16(7-3-1)9-13-19-17-10-14-21(15-11-17)18-8-4-5-12-20-18/h1-8,12,17,19H,9-11,13-15H2.
What are the key properties of N-(2-phenylethyl)-1-pyridin-2-ylpiperidin-4-amine?
N-(2-phenylethyl)-1-pyridin-2-ylpiperidin-4-amine has a molecular weight of 281.40 g/mol, XLogP of 2.88, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenylethyl)-1-pyridin-2-ylpiperidin-4-amine is sourced from PubChem (CID 43675384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).