3-N-ethyl-5-N-(4-methoxyphenyl)-5-N-methylpyridine-3,5-diamine

C15H19N3O — CID 104534077

IUPAC3-N-ethyl-5-N-(4-methoxyphenyl)-5-N-methylpyridine-3,5-diamine
SMILESCCNc1cncc(N(C)c2ccc(OC)cc2)c1
InChIInChI=1S/C15H19N3O/c1-4-17-12-9-14(11-16-10-12)18(2)13-5-7-15(19-3)8-6-13/h5-11,17H,4H2,1-3H3
InChIKeyYMMSLQANWYYIFQ-UHFFFAOYSA-N
MW257.34 g/mol
LogP3.29
Rot. Bonds5

About 3-N-ethyl-5-N-(4-methoxyphenyl)-5-N-methylpyridine-3,5-diamine

3-N-ethyl-5-N-(4-methoxyphenyl)-5-N-methylpyridine-3,5-diamine (PubChem CID 104534077) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is 3-N-ethyl-5-N-(4-methoxyphenyl)-5-N-methylpyridine-3,5-diamine.

Molecular Properties

Compound Name3-N-ethyl-5-N-(4-methoxyphenyl)-5-N-methylpyridine-3,5-diamine
PubChem CID104534077
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name3-N-ethyl-5-N-(4-methoxyphenyl)-5-N-methylpyridine-3,5-diamine
SMILESCCNc1cncc(N(C)c2ccc(OC)cc2)c1
InChIInChI=1S/C15H19N3O/c1-4-17-12-9-14(11-16-10-12)18(2)13-5-7-15(19-3)8-6-13/h5-11,17H,4H2,1-3H3
InChIKeyYMMSLQANWYYIFQ-UHFFFAOYSA-N
XLogP3.29
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-N-ethyl-5-N-(4-ethylphenyl)-5-N-methylpyridine-3,5-diamine
CID 104534081
3-N-ethyl-5-N-(4-methoxyphenyl)pyridine-3,5-diamine
CID 104532189
N-(4-methoxyphenyl)-N-methylpyrimidin-5-amine
CID 110455016
4-methoxy-N-(4-methoxyphenyl)-N-methylaniline;hydrochloride
CID 175476332
N-ethyl-4-methoxyaniline;molecular hydrogen
CID 142256400
N-ethyl-5-(4-methylphenoxy)pyridin-3-amine
CID 104536266
5-[2-(dimethylamino)-2-methylpropoxy]-N-ethylpyridin-3-amine
CID 104536911
N-(4-methoxyphenyl)-5-(N-methylanilino)pyridine-3-carboxamide
CID 109242318
3-N-ethyl-5-N-methyl-5-N-(thiophen-2-ylmethyl)pyridine-3,5-diamine
CID 104532945
N-ethyl-5-quinolin-3-yloxypyridin-3-amine
CID 107388436
5-N-(cyclobutylmethyl)-3-N-ethyl-5-N-methylpyridine-3,5-diamine
CID 104534351
3-N-ethyl-5-N-methyl-5-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyridine-3,5-diamine
CID 113423912

Frequently Asked Questions

What is the IUPAC name of 3-N-ethyl-5-N-(4-methoxyphenyl)-5-N-methylpyridine-3,5-diamine?
The IUPAC name of 3-N-ethyl-5-N-(4-methoxyphenyl)-5-N-methylpyridine-3,5-diamine (CID 104534077) is 3-N-ethyl-5-N-(4-methoxyphenyl)-5-N-methylpyridine-3,5-diamine.
What is the SMILES notation for 3-N-ethyl-5-N-(4-methoxyphenyl)-5-N-methylpyridine-3,5-diamine?
The canonical SMILES for 3-N-ethyl-5-N-(4-methoxyphenyl)-5-N-methylpyridine-3,5-diamine is CCNc1cncc(N(C)c2ccc(OC)cc2)c1.
What is the InChIKey of 3-N-ethyl-5-N-(4-methoxyphenyl)-5-N-methylpyridine-3,5-diamine?
The InChIKey is YMMSLQANWYYIFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-4-17-12-9-14(11-16-10-12)18(2)13-5-7-15(19-3)8-6-13/h5-11,17H,4H2,1-3H3.
What are the key properties of 3-N-ethyl-5-N-(4-methoxyphenyl)-5-N-methylpyridine-3,5-diamine?
3-N-ethyl-5-N-(4-methoxyphenyl)-5-N-methylpyridine-3,5-diamine has a molecular weight of 257.34 g/mol, XLogP of 3.29, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-ethyl-5-N-(4-methoxyphenyl)-5-N-methylpyridine-3,5-diamine is sourced from PubChem (CID 104534077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).