6-ethoxy-5-methyl-N-[4-(1-methylpyrazol-4-yl)phenyl]pyridin-2-amine

C18H20N4O — CID 70799339

IUPAC6-ethoxy-5-methyl-N-[4-(1-methylpyrazol-4-yl)phenyl]pyridin-2-amine
SMILESCCOc1nc(Nc2ccc(-c3cnn(C)c3)cc2)ccc1C
InChIInChI=1S/C18H20N4O/c1-4-23-18-13(2)5-10-17(21-18)20-16-8-6-14(7-9-16)15-11-19-22(3)12-15/h5-12H,4H2,1-3H3,(H,20,21)
InChIKeyKNBYJETZTKRAPR-UHFFFAOYSA-N
MW308.39 g/mol
LogP3.93
Rot. Bonds5

About 6-ethoxy-5-methyl-N-[4-(1-methylpyrazol-4-yl)phenyl]pyridin-2-amine

6-ethoxy-5-methyl-N-[4-(1-methylpyrazol-4-yl)phenyl]pyridin-2-amine (PubChem CID 70799339) has the molecular formula C18H20N4O and a molecular weight of 308.39 g/mol. Its IUPAC name is 6-ethoxy-5-methyl-N-[4-(1-methylpyrazol-4-yl)phenyl]pyridin-2-amine.

Molecular Properties

Compound Name6-ethoxy-5-methyl-N-[4-(1-methylpyrazol-4-yl)phenyl]pyridin-2-amine
PubChem CID70799339
Molecular FormulaC18H20N4O
Molecular Weight308.39 g/mol
Exact Mass308.16
IUPAC Name6-ethoxy-5-methyl-N-[4-(1-methylpyrazol-4-yl)phenyl]pyridin-2-amine
SMILESCCOc1nc(Nc2ccc(-c3cnn(C)c3)cc2)ccc1C
InChIInChI=1S/C18H20N4O/c1-4-23-18-13(2)5-10-17(21-18)20-16-8-6-14(7-9-16)15-11-19-22(3)12-15/h5-12H,4H2,1-3H3,(H,20,21)
InChIKeyKNBYJETZTKRAPR-UHFFFAOYSA-N
XLogP3.93
TPSA51.97 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.39
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(4-methoxyphenyl)-1-methylpyrazole
CID 4101323
1-methyl-4-(4-phenylphenyl)pyrazole
CID 135064285
6-ethoxy-2-N-[(1-methylpyrazol-4-yl)methyl]pyridine-2,5-diamine
CID 61351162
N-[1-[4-(1-methylpyrazol-4-yl)phenyl]ethyl]propan-1-amine
CID 54980019
4-(4-ethoxy-3-methylphenyl)-5-methyl-N-(1-methylpyrazol-4-yl)pyrimidin-2-amine
CID 164844612
6-(2-methylpropoxy)-2-N-(1-methylpyrazol-4-yl)pyridine-2,5-diamine
CID 79770641
4-ethoxy-6-(1-methylpyrazol-4-yl)pteridin-2-amine
CID 68774809
N-methyl-1-[4-(1-methylpyrazol-4-yl)phenyl]methanamine
CID 61033287
5-chloro-4-(1-methylpyrazol-4-yl)-N-[4-(3-methyl-1,2,4-triazol-1-yl)phenyl]pyridin-2-amine
CID 117077481
6-ethoxy-2-N-phenylpyridine-2,5-diamine
CID 43261284
[4-(1-methylpyrazol-4-yl)phenyl]thiourea
CID 169356710
ethyl 2-[[7-(1-methylpyrazol-4-yl)-1,5-naphthyridin-2-yl]amino]-1,3-thiazole-5-carboxylate
CID 90287809

Frequently Asked Questions

What is the IUPAC name of 6-ethoxy-5-methyl-N-[4-(1-methylpyrazol-4-yl)phenyl]pyridin-2-amine?
The IUPAC name of 6-ethoxy-5-methyl-N-[4-(1-methylpyrazol-4-yl)phenyl]pyridin-2-amine (CID 70799339) is 6-ethoxy-5-methyl-N-[4-(1-methylpyrazol-4-yl)phenyl]pyridin-2-amine.
What is the SMILES notation for 6-ethoxy-5-methyl-N-[4-(1-methylpyrazol-4-yl)phenyl]pyridin-2-amine?
The canonical SMILES for 6-ethoxy-5-methyl-N-[4-(1-methylpyrazol-4-yl)phenyl]pyridin-2-amine is CCOc1nc(Nc2ccc(-c3cnn(C)c3)cc2)ccc1C.
What is the InChIKey of 6-ethoxy-5-methyl-N-[4-(1-methylpyrazol-4-yl)phenyl]pyridin-2-amine?
The InChIKey is KNBYJETZTKRAPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4O/c1-4-23-18-13(2)5-10-17(21-18)20-16-8-6-14(7-9-16)15-11-19-22(3)12-15/h5-12H,4H2,1-3H3,(H,20,21).
What are the key properties of 6-ethoxy-5-methyl-N-[4-(1-methylpyrazol-4-yl)phenyl]pyridin-2-amine?
6-ethoxy-5-methyl-N-[4-(1-methylpyrazol-4-yl)phenyl]pyridin-2-amine has a molecular weight of 308.39 g/mol, XLogP of 3.93, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethoxy-5-methyl-N-[4-(1-methylpyrazol-4-yl)phenyl]pyridin-2-amine is sourced from PubChem (CID 70799339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).