6-ethoxy-2-N-[(3-methoxyphenyl)methyl]pyridine-2,5-diamine

C15H19N3O2 — CID 61028652

IUPAC6-ethoxy-2-N-[(3-methoxyphenyl)methyl]pyridine-2,5-diamine
SMILESCCOc1nc(NCc2cccc(OC)c2)ccc1N
InChIInChI=1S/C15H19N3O2/c1-3-20-15-13(16)7-8-14(18-15)17-10-11-5-4-6-12(9-11)19-2/h4-9H,3,10,16H2,1-2H3,(H,17,18)
InChIKeyVPRCOJVUAGTOHF-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.68
Rot. Bonds6

About 6-ethoxy-2-N-[(3-methoxyphenyl)methyl]pyridine-2,5-diamine

6-ethoxy-2-N-[(3-methoxyphenyl)methyl]pyridine-2,5-diamine (PubChem CID 61028652) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is 6-ethoxy-2-N-[(3-methoxyphenyl)methyl]pyridine-2,5-diamine.

Molecular Properties

Compound Name6-ethoxy-2-N-[(3-methoxyphenyl)methyl]pyridine-2,5-diamine
PubChem CID61028652
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name6-ethoxy-2-N-[(3-methoxyphenyl)methyl]pyridine-2,5-diamine
SMILESCCOc1nc(NCc2cccc(OC)c2)ccc1N
InChIInChI=1S/C15H19N3O2/c1-3-20-15-13(16)7-8-14(18-15)17-10-11-5-4-6-12(9-11)19-2/h4-9H,3,10,16H2,1-2H3,(H,17,18)
InChIKeyVPRCOJVUAGTOHF-UHFFFAOYSA-N
XLogP2.68
TPSA69.40 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 52.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-N-[(3-methoxyphenyl)methyl]pyridine-2,3,6-triamine
CID 79826816
6-N-[(3-ethoxyphenyl)methyl]pyridine-2,6-diamine
CID 80647155
6-ethoxy-2-N-[(4-methylphenyl)methyl]pyridine-2,5-diamine
CID 43261190
6-chloro-N-[(3-methoxyphenyl)methyl]pyridin-2-amine
CID 63587268
2-ethoxy-6-(3-ethylphenoxy)pyridin-3-amine
CID 43262375
2-N-[(3-methoxyphenyl)methyl]-6-methylpyridine-2,3-diamine
CID 81131728
2-N-[(3-methoxyphenyl)methyl]pyridine-2,3-diamine
CID 61029303
5-fluoro-N-[(3-methoxyphenyl)methyl]pyridin-2-amine
CID 61313135
4-ethoxy-N-[(3-methoxyphenyl)methyl]-6-methylpyrimidin-2-amine
CID 115974506
2-ethoxy-6-(3-methoxyphenyl)sulfanylpyridin-3-amine
CID 43262702
6-ethoxy-2-N-[(1-methylpyrazol-4-yl)methyl]pyridine-2,5-diamine
CID 61351162
4-N-[(3-ethoxyphenyl)methyl]pyrimidine-4,6-diamine
CID 115612215

Frequently Asked Questions

What is the IUPAC name of 6-ethoxy-2-N-[(3-methoxyphenyl)methyl]pyridine-2,5-diamine?
The IUPAC name of 6-ethoxy-2-N-[(3-methoxyphenyl)methyl]pyridine-2,5-diamine (CID 61028652) is 6-ethoxy-2-N-[(3-methoxyphenyl)methyl]pyridine-2,5-diamine.
What is the SMILES notation for 6-ethoxy-2-N-[(3-methoxyphenyl)methyl]pyridine-2,5-diamine?
The canonical SMILES for 6-ethoxy-2-N-[(3-methoxyphenyl)methyl]pyridine-2,5-diamine is CCOc1nc(NCc2cccc(OC)c2)ccc1N.
What is the InChIKey of 6-ethoxy-2-N-[(3-methoxyphenyl)methyl]pyridine-2,5-diamine?
The InChIKey is VPRCOJVUAGTOHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-3-20-15-13(16)7-8-14(18-15)17-10-11-5-4-6-12(9-11)19-2/h4-9H,3,10,16H2,1-2H3,(H,17,18).
What are the key properties of 6-ethoxy-2-N-[(3-methoxyphenyl)methyl]pyridine-2,5-diamine?
6-ethoxy-2-N-[(3-methoxyphenyl)methyl]pyridine-2,5-diamine has a molecular weight of 273.34 g/mol, XLogP of 2.68, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethoxy-2-N-[(3-methoxyphenyl)methyl]pyridine-2,5-diamine is sourced from PubChem (CID 61028652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).