N-[2-(1-aminoethyl)phenyl]pyridin-4-amine

C13H15N3 — CID 63761448

IUPACN-[2-(1-aminoethyl)phenyl]pyridin-4-amine
SMILESCC(N)c1ccccc1Nc1ccncc1
InChIInChI=1S/C13H15N3/c1-10(14)12-4-2-3-5-13(12)16-11-6-8-15-9-7-11/h2-10H,14H2,1H3,(H,15,16)
InChIKeyLYIAXOLGMXZZAH-UHFFFAOYSA-N
MW213.28 g/mol
LogP2.84
Rot. Bonds3

About N-[2-(1-aminoethyl)phenyl]pyridin-4-amine

N-[2-(1-aminoethyl)phenyl]pyridin-4-amine (PubChem CID 63761448) has the molecular formula C13H15N3 and a molecular weight of 213.28 g/mol. Its IUPAC name is N-[2-(1-aminoethyl)phenyl]pyridin-4-amine.

Molecular Properties

Compound NameN-[2-(1-aminoethyl)phenyl]pyridin-4-amine
PubChem CID63761448
Molecular FormulaC13H15N3
Molecular Weight213.28 g/mol
Exact Mass213.13
IUPAC NameN-[2-(1-aminoethyl)phenyl]pyridin-4-amine
SMILESCC(N)c1ccccc1Nc1ccncc1
InChIInChI=1S/C13H15N3/c1-10(14)12-4-2-3-5-13(12)16-11-6-8-15-9-7-11/h2-10H,14H2,1H3,(H,15,16)
InChIKeyLYIAXOLGMXZZAH-UHFFFAOYSA-N
XLogP2.84
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[2-(1-aminoethyl)phenyl]pyridin-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

Frequently Asked Questions

What is the IUPAC name of N-[2-(1-aminoethyl)phenyl]pyridin-4-amine?
The IUPAC name of N-[2-(1-aminoethyl)phenyl]pyridin-4-amine (CID 63761448) is N-[2-(1-aminoethyl)phenyl]pyridin-4-amine.
What is the SMILES notation for N-[2-(1-aminoethyl)phenyl]pyridin-4-amine?
The canonical SMILES for N-[2-(1-aminoethyl)phenyl]pyridin-4-amine is CC(N)c1ccccc1Nc1ccncc1.
What is the InChIKey of N-[2-(1-aminoethyl)phenyl]pyridin-4-amine?
The InChIKey is LYIAXOLGMXZZAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3/c1-10(14)12-4-2-3-5-13(12)16-11-6-8-15-9-7-11/h2-10H,14H2,1H3,(H,15,16).
What are the key properties of N-[2-(1-aminoethyl)phenyl]pyridin-4-amine?
N-[2-(1-aminoethyl)phenyl]pyridin-4-amine has a molecular weight of 213.28 g/mol, XLogP of 2.84, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-aminoethyl)phenyl]pyridin-4-amine is sourced from PubChem (CID 63761448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).