2-N-(3,4-dimethylphenyl)-2-N,3-dimethylpyridine-2,5-diamine

C15H19N3 — CID 115147871

IUPAC2-N-(3,4-dimethylphenyl)-2-N,3-dimethylpyridine-2,5-diamine
SMILESCc1ccc(N(C)c2ncc(N)cc2C)cc1C
InChIInChI=1S/C15H19N3/c1-10-5-6-14(8-11(10)2)18(4)15-12(3)7-13(16)9-17-15/h5-9H,16H2,1-4H3
InChIKeyHYECATWEALOIGP-UHFFFAOYSA-N
MW241.34 g/mol
LogP3.36
Rot. Bonds2

About 2-N-(3,4-dimethylphenyl)-2-N,3-dimethylpyridine-2,5-diamine

2-N-(3,4-dimethylphenyl)-2-N,3-dimethylpyridine-2,5-diamine (PubChem CID 115147871) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is 2-N-(3,4-dimethylphenyl)-2-N,3-dimethylpyridine-2,5-diamine.

Molecular Properties

Compound Name2-N-(3,4-dimethylphenyl)-2-N,3-dimethylpyridine-2,5-diamine
PubChem CID115147871
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC Name2-N-(3,4-dimethylphenyl)-2-N,3-dimethylpyridine-2,5-diamine
SMILESCc1ccc(N(C)c2ncc(N)cc2C)cc1C
InChIInChI=1S/C15H19N3/c1-10-5-6-14(8-11(10)2)18(4)15-12(3)7-13(16)9-17-15/h5-9H,16H2,1-4H3
InChIKeyHYECATWEALOIGP-UHFFFAOYSA-N
XLogP3.36
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-N-(3,4-dimethylphenyl)-2-N,3-dimethylpyridine-2,5-diamine?
The IUPAC name of 2-N-(3,4-dimethylphenyl)-2-N,3-dimethylpyridine-2,5-diamine (CID 115147871) is 2-N-(3,4-dimethylphenyl)-2-N,3-dimethylpyridine-2,5-diamine.
What is the SMILES notation for 2-N-(3,4-dimethylphenyl)-2-N,3-dimethylpyridine-2,5-diamine?
The canonical SMILES for 2-N-(3,4-dimethylphenyl)-2-N,3-dimethylpyridine-2,5-diamine is Cc1ccc(N(C)c2ncc(N)cc2C)cc1C.
What is the InChIKey of 2-N-(3,4-dimethylphenyl)-2-N,3-dimethylpyridine-2,5-diamine?
The InChIKey is HYECATWEALOIGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-10-5-6-14(8-11(10)2)18(4)15-12(3)7-13(16)9-17-15/h5-9H,16H2,1-4H3.
What are the key properties of 2-N-(3,4-dimethylphenyl)-2-N,3-dimethylpyridine-2,5-diamine?
2-N-(3,4-dimethylphenyl)-2-N,3-dimethylpyridine-2,5-diamine has a molecular weight of 241.34 g/mol, XLogP of 3.36, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(3,4-dimethylphenyl)-2-N,3-dimethylpyridine-2,5-diamine is sourced from PubChem (CID 115147871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).