N-(2-phenylethoxy)pyridin-2-amine

C13H14N2O — CID 154397443

IUPACN-(2-phenylethoxy)pyridin-2-amine
SMILESc1ccc(CCONc2ccccn2)cc1
InChIInChI=1S/C13H14N2O/c1-2-6-12(7-3-1)9-11-16-15-13-8-4-5-10-14-13/h1-8,10H,9,11H2,(H,14,15)
InChIKeyGZWRWLNSRDXCFF-UHFFFAOYSA-N
MW214.27 g/mol
LogP2.67
Rot. Bonds5

About N-(2-phenylethoxy)pyridin-2-amine

N-(2-phenylethoxy)pyridin-2-amine (PubChem CID 154397443) has the molecular formula C13H14N2O and a molecular weight of 214.27 g/mol. Its IUPAC name is N-(2-phenylethoxy)pyridin-2-amine.

Molecular Properties

Compound NameN-(2-phenylethoxy)pyridin-2-amine
PubChem CID154397443
Molecular FormulaC13H14N2O
Molecular Weight214.27 g/mol
Exact Mass214.11
IUPAC NameN-(2-phenylethoxy)pyridin-2-amine
SMILESc1ccc(CCONc2ccccn2)cc1
InChIInChI=1S/C13H14N2O/c1-2-6-12(7-3-1)9-11-16-15-13-8-4-5-10-14-13/h1-8,10H,9,11H2,(H,14,15)
InChIKeyGZWRWLNSRDXCFF-UHFFFAOYSA-N
XLogP2.67
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(2-phenylethoxy)pyridin-2-amine?
The IUPAC name of N-(2-phenylethoxy)pyridin-2-amine (CID 154397443) is N-(2-phenylethoxy)pyridin-2-amine.
What is the SMILES notation for N-(2-phenylethoxy)pyridin-2-amine?
The canonical SMILES for N-(2-phenylethoxy)pyridin-2-amine is c1ccc(CCONc2ccccn2)cc1.
What is the InChIKey of N-(2-phenylethoxy)pyridin-2-amine?
The InChIKey is GZWRWLNSRDXCFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O/c1-2-6-12(7-3-1)9-11-16-15-13-8-4-5-10-14-13/h1-8,10H,9,11H2,(H,14,15).
What are the key properties of N-(2-phenylethoxy)pyridin-2-amine?
N-(2-phenylethoxy)pyridin-2-amine has a molecular weight of 214.27 g/mol, XLogP of 2.67, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenylethoxy)pyridin-2-amine is sourced from PubChem (CID 154397443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).