3-N-ethyl-5-N-phenylpyridine-3,5-diamine

C13H15N3 — CID 104532192

IUPAC3-N-ethyl-5-N-phenylpyridine-3,5-diamine
SMILESCCNc1cncc(Nc2ccccc2)c1
InChIInChI=1S/C13H15N3/c1-2-15-12-8-13(10-14-9-12)16-11-6-4-3-5-7-11/h3-10,15-16H,2H2,1H3
InChIKeyXSJFGADIFHUCOZ-UHFFFAOYSA-N
MW213.28 g/mol
LogP3.26
Rot. Bonds4

About 3-N-ethyl-5-N-phenylpyridine-3,5-diamine

3-N-ethyl-5-N-phenylpyridine-3,5-diamine (PubChem CID 104532192) has the molecular formula C13H15N3 and a molecular weight of 213.28 g/mol. Its IUPAC name is 3-N-ethyl-5-N-phenylpyridine-3,5-diamine.

Molecular Properties

Compound Name3-N-ethyl-5-N-phenylpyridine-3,5-diamine
PubChem CID104532192
Molecular FormulaC13H15N3
Molecular Weight213.28 g/mol
Exact Mass213.13
IUPAC Name3-N-ethyl-5-N-phenylpyridine-3,5-diamine
SMILESCCNc1cncc(Nc2ccccc2)c1
InChIInChI=1S/C13H15N3/c1-2-15-12-8-13(10-14-9-12)16-11-6-4-3-5-7-11/h3-10,15-16H,2H2,1H3
InChIKeyXSJFGADIFHUCOZ-UHFFFAOYSA-N
XLogP3.26
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 53.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-N-ethyl-5-N-phenylpyridine-3,5-diamine 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

5-N-(4-bromophenyl)-3-N-ethylpyridine-3,5-diamine
CID 104532357
3-N-ethyl-5-N-(4-propan-2-ylphenyl)pyridine-3,5-diamine
CID 104532249
3-N-ethyl-5-N-(4-methoxyphenyl)pyridine-3,5-diamine
CID 104532189
5-N-(3,4-dichlorophenyl)-3-N-ethylpyridine-3,5-diamine
CID 104532261
5-N-(2-tert-butylphenyl)-3-N-ethylpyridine-3,5-diamine
CID 104534804
3-N-ethyl-5-N-(4-pyrrolidin-1-ylphenyl)pyridine-3,5-diamine
CID 104534517
3-N-ethyl-5-N-methyl-5-N-phenylpyridine-3,5-diamine
CID 104532448
3-N-ethyl-5-N-(2-phenoxyethyl)pyridine-3,5-diamine
CID 104533858
5-N-(3-bromo-2-methylphenyl)-3-N-ethylpyridine-3,5-diamine
CID 107638767
N-ethyl-5-(2-phenoxyethoxy)pyridin-3-amine
CID 104536114
5-N-(4-ethoxy-3-fluorophenyl)-3-N-ethylpyridine-3,5-diamine
CID 104535772
5-N-butyl-3-N-ethylpyridine-3,5-diamine
CID 104532629

Frequently Asked Questions

What is the IUPAC name of 3-N-ethyl-5-N-phenylpyridine-3,5-diamine?
The IUPAC name of 3-N-ethyl-5-N-phenylpyridine-3,5-diamine (CID 104532192) is 3-N-ethyl-5-N-phenylpyridine-3,5-diamine.
What is the SMILES notation for 3-N-ethyl-5-N-phenylpyridine-3,5-diamine?
The canonical SMILES for 3-N-ethyl-5-N-phenylpyridine-3,5-diamine is CCNc1cncc(Nc2ccccc2)c1.
What is the InChIKey of 3-N-ethyl-5-N-phenylpyridine-3,5-diamine?
The InChIKey is XSJFGADIFHUCOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3/c1-2-15-12-8-13(10-14-9-12)16-11-6-4-3-5-7-11/h3-10,15-16H,2H2,1H3.
What are the key properties of 3-N-ethyl-5-N-phenylpyridine-3,5-diamine?
3-N-ethyl-5-N-phenylpyridine-3,5-diamine has a molecular weight of 213.28 g/mol, XLogP of 3.26, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-ethyl-5-N-phenylpyridine-3,5-diamine is sourced from PubChem (CID 104532192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).