3-ethoxy-5-(2-methoxypyridin-1-ium-3-yl)-N-(6-methyl-2-pyridinyl)pyridin-2-amine

C19H21N4O2+ — CID 11290664

IUPAC3-ethoxy-5-(2-methoxypyridin-1-ium-3-yl)-N-(6-methyl-2-pyridinyl)pyridin-2-amine
SMILESCCOc1cc(-c2ccc[nH+]c2OC)cnc1Nc1cccc(C)n1
InChIInChI=1S/C19H20N4O2/c1-4-25-16-11-14(15-8-6-10-20-19(15)24-3)12-21-18(16)23-17-9-5-7-13(2)22-17/h5-12H,4H2,1-3H3,(H,21,22,23)/p+1
InChIKeyOYBASKJYQAKUHJ-UHFFFAOYSA-O
MW337.40 g/mol
LogP3.42
Rot. Bonds6

About 3-ethoxy-5-(2-methoxypyridin-1-ium-3-yl)-N-(6-methyl-2-pyridinyl)pyridin-2-amine

3-ethoxy-5-(2-methoxypyridin-1-ium-3-yl)-N-(6-methyl-2-pyridinyl)pyridin-2-amine (PubChem CID 11290664) has the molecular formula C19H21N4O2+ and a molecular weight of 337.40 g/mol. Its IUPAC name is 3-ethoxy-5-(2-methoxypyridin-1-ium-3-yl)-N-(6-methyl-2-pyridinyl)pyridin-2-amine.

Molecular Properties

Compound Name3-ethoxy-5-(2-methoxypyridin-1-ium-3-yl)-N-(6-methyl-2-pyridinyl)pyridin-2-amine
PubChem CID11290664
Molecular FormulaC19H21N4O2+
Molecular Weight337.40 g/mol
Exact Mass337.17
IUPAC Name3-ethoxy-5-(2-methoxypyridin-1-ium-3-yl)-N-(6-methyl-2-pyridinyl)pyridin-2-amine
SMILESCCOc1cc(-c2ccc[nH+]c2OC)cnc1Nc1cccc(C)n1
InChIInChI=1S/C19H20N4O2/c1-4-25-16-11-14(15-8-6-10-20-19(15)24-3)12-21-18(16)23-17-9-5-7-13(2)22-17/h5-12H,4H2,1-3H3,(H,21,22,23)/p+1
InChIKeyOYBASKJYQAKUHJ-UHFFFAOYSA-O
XLogP3.42
TPSA70.41 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.40
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-ethoxy-5-(2-methylphenyl)-N-(6-methyl-2-pyridinyl)pyridin-2-amine
CID 86036475
3-ethoxy-5-(5-fluoro-2-methoxyphenyl)-N-(6-methyl-2-pyridinyl)pyridin-2-amine
CID 11164030
3-ethoxy-N-(6-methyl-2-pyridinyl)-5-pyridin-2-ylpyridin-2-amine
CID 11220495
5-(benzhydrylideneamino)-3-ethoxy-N-(6-methyl-2-pyridinyl)pyridin-2-amine
CID 86610310
3-ethoxy-4-methyl-N-(6-methyl-2-pyridinyl)pyridin-2-amine
CID 11356950
N-(3,4-diethoxyphenyl)-N'-(6-methyl-2-pyridinyl)oxamide
CID 108519873
2-[[2-[(6-methyl-2-pyridinyl)amino]-3-pyridinyl]oxy]acetonitrile
CID 11276507
methyl 6-[(3-ethoxy-2-pyridinyl)amino]pyridine-2-carboxylate
CID 11346332
6-(4-ethoxy-3-methylanilino)pyridine-2-carbonitrile
CID 133392258
N-[(3-ethoxy-4-methoxyphenyl)methyl]-3,6-dimethylpyrazin-2-amine
CID 133471195
N-[(3-chloro-4-methoxyphenyl)methyl]-6-methylpyridin-2-amine
CID 133378421
4-bromo-3-ethoxy-N-(6-methyl-2-pyridinyl)benzenesulfonamide
CID 47071432

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-5-(2-methoxypyridin-1-ium-3-yl)-N-(6-methyl-2-pyridinyl)pyridin-2-amine?
The IUPAC name of 3-ethoxy-5-(2-methoxypyridin-1-ium-3-yl)-N-(6-methyl-2-pyridinyl)pyridin-2-amine (CID 11290664) is 3-ethoxy-5-(2-methoxypyridin-1-ium-3-yl)-N-(6-methyl-2-pyridinyl)pyridin-2-amine.
What is the SMILES notation for 3-ethoxy-5-(2-methoxypyridin-1-ium-3-yl)-N-(6-methyl-2-pyridinyl)pyridin-2-amine?
The canonical SMILES for 3-ethoxy-5-(2-methoxypyridin-1-ium-3-yl)-N-(6-methyl-2-pyridinyl)pyridin-2-amine is CCOc1cc(-c2ccc[nH+]c2OC)cnc1Nc1cccc(C)n1.
What is the InChIKey of 3-ethoxy-5-(2-methoxypyridin-1-ium-3-yl)-N-(6-methyl-2-pyridinyl)pyridin-2-amine?
The InChIKey is OYBASKJYQAKUHJ-UHFFFAOYSA-O. The full InChI is InChI=1S/C19H20N4O2/c1-4-25-16-11-14(15-8-6-10-20-19(15)24-3)12-21-18(16)23-17-9-5-7-13(2)22-17/h5-12H,4H2,1-3H3,(H,21,22,23)/p+1.
What are the key properties of 3-ethoxy-5-(2-methoxypyridin-1-ium-3-yl)-N-(6-methyl-2-pyridinyl)pyridin-2-amine?
3-ethoxy-5-(2-methoxypyridin-1-ium-3-yl)-N-(6-methyl-2-pyridinyl)pyridin-2-amine has a molecular weight of 337.40 g/mol, XLogP of 3.42, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-5-(2-methoxypyridin-1-ium-3-yl)-N-(6-methyl-2-pyridinyl)pyridin-2-amine is sourced from PubChem (CID 11290664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).