2-N-(3,5-dimethylphenyl)-6-propan-2-yloxypyridine-2,5-diamine

C16H21N3O — CID 43261617

IUPAC2-N-(3,5-dimethylphenyl)-6-propan-2-yloxypyridine-2,5-diamine
SMILESCc1cc(C)cc(Nc2ccc(N)c(OC(C)C)n2)c1
InChIInChI=1S/C16H21N3O/c1-10(2)20-16-14(17)5-6-15(19-16)18-13-8-11(3)7-12(4)9-13/h5-10H,17H2,1-4H3,(H,18,19)
InChIKeyXQERRYHXJJTEOH-UHFFFAOYSA-N
MW271.36 g/mol
LogP3.81
Rot. Bonds4

About 2-N-(3,5-dimethylphenyl)-6-propan-2-yloxypyridine-2,5-diamine

2-N-(3,5-dimethylphenyl)-6-propan-2-yloxypyridine-2,5-diamine (PubChem CID 43261617) has the molecular formula C16H21N3O and a molecular weight of 271.36 g/mol. Its IUPAC name is 2-N-(3,5-dimethylphenyl)-6-propan-2-yloxypyridine-2,5-diamine.

Molecular Properties

Compound Name2-N-(3,5-dimethylphenyl)-6-propan-2-yloxypyridine-2,5-diamine
PubChem CID43261617
Molecular FormulaC16H21N3O
Molecular Weight271.36 g/mol
Exact Mass271.17
IUPAC Name2-N-(3,5-dimethylphenyl)-6-propan-2-yloxypyridine-2,5-diamine
SMILESCc1cc(C)cc(Nc2ccc(N)c(OC(C)C)n2)c1
InChIInChI=1S/C16H21N3O/c1-10(2)20-16-14(17)5-6-15(19-16)18-13-8-11(3)7-12(4)9-13/h5-10H,17H2,1-4H3,(H,18,19)
InChIKeyXQERRYHXJJTEOH-UHFFFAOYSA-N
XLogP3.81
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 53.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-N-(3,5-dimethylphenyl)-6-propan-2-yloxypyridine-2,5-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

2-N-(3-bromophenyl)-6-propan-2-yloxypyridine-2,5-diamine
CID 43261575
2-N-(3-chloro-5-fluorophenyl)-6-propan-2-yloxypyridine-2,5-diamine
CID 107363647
2-N-(4-methylsulfanylphenyl)-6-propan-2-yloxypyridine-2,5-diamine
CID 43261396
2-N-(3-methylbutan-2-yl)-6-propan-2-yloxypyridine-2,5-diamine
CID 43261264
2-N-(3-fluoro-5-methylphenyl)-6-(2-methylpropoxy)pyridine-2,5-diamine
CID 79041425
2-N-(1-benzothiophen-5-yl)-6-propan-2-yloxypyridine-2,5-diamine
CID 65475242
2-N-(3-bromo-2-methylphenyl)-6-propan-2-yloxypyridine-2,5-diamine
CID 107633622
2-N-(2,6-dichloro-4-fluorophenyl)-6-propan-2-yloxypyridine-2,5-diamine
CID 83077911
2-N-(2-bromo-4-chlorophenyl)-6-propan-2-yloxypyridine-2,5-diamine
CID 81262204
2-N-(3,5-dimethylphenyl)-2-N-methyl-6-propan-2-yloxypyridine-2,5-diamine
CID 63405892
2-N-(2,6-difluoro-3-methylphenyl)-6-propan-2-yloxypyridine-2,5-diamine
CID 82798611
2-N-(5-bromo-2-methoxyphenyl)-6-propan-2-yloxypyridine-2,5-diamine
CID 63403025

Frequently Asked Questions

What is the IUPAC name of 2-N-(3,5-dimethylphenyl)-6-propan-2-yloxypyridine-2,5-diamine?
The IUPAC name of 2-N-(3,5-dimethylphenyl)-6-propan-2-yloxypyridine-2,5-diamine (CID 43261617) is 2-N-(3,5-dimethylphenyl)-6-propan-2-yloxypyridine-2,5-diamine.
What is the SMILES notation for 2-N-(3,5-dimethylphenyl)-6-propan-2-yloxypyridine-2,5-diamine?
The canonical SMILES for 2-N-(3,5-dimethylphenyl)-6-propan-2-yloxypyridine-2,5-diamine is Cc1cc(C)cc(Nc2ccc(N)c(OC(C)C)n2)c1.
What is the InChIKey of 2-N-(3,5-dimethylphenyl)-6-propan-2-yloxypyridine-2,5-diamine?
The InChIKey is XQERRYHXJJTEOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O/c1-10(2)20-16-14(17)5-6-15(19-16)18-13-8-11(3)7-12(4)9-13/h5-10H,17H2,1-4H3,(H,18,19).
What are the key properties of 2-N-(3,5-dimethylphenyl)-6-propan-2-yloxypyridine-2,5-diamine?
2-N-(3,5-dimethylphenyl)-6-propan-2-yloxypyridine-2,5-diamine has a molecular weight of 271.36 g/mol, XLogP of 3.81, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(3,5-dimethylphenyl)-6-propan-2-yloxypyridine-2,5-diamine is sourced from PubChem (CID 43261617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).