6-N-[2-(3-methoxyphenyl)ethyl]-2-N-methylpyridine-2,6-diamine

C15H19N3O — CID 107855522

IUPAC6-N-[2-(3-methoxyphenyl)ethyl]-2-N-methylpyridine-2,6-diamine
SMILESCNc1cccc(NCCc2cccc(OC)c2)n1
InChIInChI=1S/C15H19N3O/c1-16-14-7-4-8-15(18-14)17-10-9-12-5-3-6-13(11-12)19-2/h3-8,11H,9-10H2,1-2H3,(H2,16,17,18)
InChIKeyGRXZBHOMHWDAEK-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.79
Rot. Bonds6

About 6-N-[2-(3-methoxyphenyl)ethyl]-2-N-methylpyridine-2,6-diamine

6-N-[2-(3-methoxyphenyl)ethyl]-2-N-methylpyridine-2,6-diamine (PubChem CID 107855522) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is 6-N-[2-(3-methoxyphenyl)ethyl]-2-N-methylpyridine-2,6-diamine.

Molecular Properties

Compound Name6-N-[2-(3-methoxyphenyl)ethyl]-2-N-methylpyridine-2,6-diamine
PubChem CID107855522
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name6-N-[2-(3-methoxyphenyl)ethyl]-2-N-methylpyridine-2,6-diamine
SMILESCNc1cccc(NCCc2cccc(OC)c2)n1
InChIInChI=1S/C15H19N3O/c1-16-14-7-4-8-15(18-14)17-10-9-12-5-3-6-13(11-12)19-2/h3-8,11H,9-10H2,1-2H3,(H2,16,17,18)
InChIKeyGRXZBHOMHWDAEK-UHFFFAOYSA-N
XLogP2.79
TPSA46.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-ethoxy-N-[2-(3-methoxyphenyl)ethyl]pyridin-2-amine
CID 107851217
5-methoxy-N-[2-(3-methoxyphenyl)ethyl]pyridin-2-amine
CID 104861065
4-N-[2-(3-methoxyphenyl)ethyl]-2-N-[2-(4-methoxyphenyl)ethyl]pyrimidine-2,4-diamine
CID 112895126
4-N-[2-(3-methoxyphenyl)ethyl]-2-methylpyrimidine-4,6-diamine
CID 107855538
6-N-butyl-4-N-[2-(3-methoxyphenyl)ethyl]pyrimidine-4,6-diamine
CID 112855106
4-N-tert-butyl-2-N-[2-(3-methoxyphenyl)ethyl]pyrimidine-2,4-diamine
CID 112895252
6-[3-(3-methoxyphenyl)propylamino]pyridine-2-carboxylic acid
CID 122053549
4-N-[2-(3-methoxyphenyl)ethyl]-2-N-[2-(4-methoxyphenyl)ethyl]-6-methylpyrimidine-2,4-diamine
CID 112921111
4-N-[2-(3-methoxyphenyl)ethyl]-2-N-(pyridin-4-ylmethyl)pyrimidine-2,4-diamine
CID 112893824
2-N-[2-(3-methoxyphenyl)ethyl]-4-N-(3-methylbutyl)pyrimidine-2,4-diamine
CID 112895255
4-N-[2-(3-methoxyphenyl)ethyl]-2-N-(3-methylbutyl)pyrimidine-2,4-diamine
CID 112895145
2-N-(3-methoxyphenyl)-4-N-[2-(3-methoxyphenyl)ethyl]-6-methylpyrimidine-2,4-diamine
CID 112921166

Frequently Asked Questions

What is the IUPAC name of 6-N-[2-(3-methoxyphenyl)ethyl]-2-N-methylpyridine-2,6-diamine?
The IUPAC name of 6-N-[2-(3-methoxyphenyl)ethyl]-2-N-methylpyridine-2,6-diamine (CID 107855522) is 6-N-[2-(3-methoxyphenyl)ethyl]-2-N-methylpyridine-2,6-diamine.
What is the SMILES notation for 6-N-[2-(3-methoxyphenyl)ethyl]-2-N-methylpyridine-2,6-diamine?
The canonical SMILES for 6-N-[2-(3-methoxyphenyl)ethyl]-2-N-methylpyridine-2,6-diamine is CNc1cccc(NCCc2cccc(OC)c2)n1.
What is the InChIKey of 6-N-[2-(3-methoxyphenyl)ethyl]-2-N-methylpyridine-2,6-diamine?
The InChIKey is GRXZBHOMHWDAEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-16-14-7-4-8-15(18-14)17-10-9-12-5-3-6-13(11-12)19-2/h3-8,11H,9-10H2,1-2H3,(H2,16,17,18).
What are the key properties of 6-N-[2-(3-methoxyphenyl)ethyl]-2-N-methylpyridine-2,6-diamine?
6-N-[2-(3-methoxyphenyl)ethyl]-2-N-methylpyridine-2,6-diamine has a molecular weight of 257.34 g/mol, XLogP of 2.79, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-[2-(3-methoxyphenyl)ethyl]-2-N-methylpyridine-2,6-diamine is sourced from PubChem (CID 107855522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).