[1-(2-methoxyphenyl)-5-(4-methoxyphenyl)pyrazol-3-yl]methanamine

C18H19N3O2 — CID 82071949

IUPAC[1-(2-methoxyphenyl)-5-(4-methoxyphenyl)pyrazol-3-yl]methanamine
SMILESCOc1ccc(-c2cc(CN)nn2-c2ccccc2OC)cc1
InChIInChI=1S/C18H19N3O2/c1-22-15-9-7-13(8-10-15)17-11-14(12-19)20-21(17)16-5-3-4-6-18(16)23-2/h3-11H,12,19H2,1-2H3
InChIKeyUIUCYCZCVOKJFL-UHFFFAOYSA-N
MW309.37 g/mol
LogP3.02
Rot. Bonds5

About [1-(2-methoxyphenyl)-5-(4-methoxyphenyl)pyrazol-3-yl]methanamine

[1-(2-methoxyphenyl)-5-(4-methoxyphenyl)pyrazol-3-yl]methanamine (PubChem CID 82071949) has the molecular formula C18H19N3O2 and a molecular weight of 309.37 g/mol. Its IUPAC name is [1-(2-methoxyphenyl)-5-(4-methoxyphenyl)pyrazol-3-yl]methanamine.

Molecular Properties

Compound Name[1-(2-methoxyphenyl)-5-(4-methoxyphenyl)pyrazol-3-yl]methanamine
PubChem CID82071949
Molecular FormulaC18H19N3O2
Molecular Weight309.37 g/mol
Exact Mass309.15
IUPAC Name[1-(2-methoxyphenyl)-5-(4-methoxyphenyl)pyrazol-3-yl]methanamine
SMILESCOc1ccc(-c2cc(CN)nn2-c2ccccc2OC)cc1
InChIInChI=1S/C18H19N3O2/c1-22-15-9-7-13(8-10-15)17-11-14(12-19)20-21(17)16-5-3-4-6-18(16)23-2/h3-11H,12,19H2,1-2H3
InChIKeyUIUCYCZCVOKJFL-UHFFFAOYSA-N
XLogP3.02
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[5-(3,4-dimethoxyphenyl)-1-(2-methylphenyl)pyrazol-3-yl]methanamine
CID 82072345
[1-(4-methoxyphenyl)-5-(4-methylphenyl)pyrazol-3-yl]methanamine
CID 82072095
[1-(4-chlorophenyl)-5-(4-methoxyphenyl)pyrazol-3-yl]methanamine
CID 82071935
3-(chloromethyl)-1-[2-(4-methoxyphenyl)phenyl]-5-phenylpyrazole
CID 174958210
[5-(4-fluorophenyl)-1-(2-methylphenyl)pyrazol-3-yl]methanamine
CID 82072215
3,5-bis(4-chlorophenyl)-1-(2-methoxyphenyl)pyrazole
CID 4575566
1-(2-ethylphenyl)-3,5-bis(4-methoxyphenyl)pyrazole
CID 19587123
2-[1-(3,4-dimethylphenyl)-5-(4-methoxyphenyl)pyrazol-3-yl]ethanamine
CID 82071889
[1-(5-chloro-2-methylphenyl)-5-(2-methoxyphenyl)pyrazol-3-yl]methanamine
CID 82072567
[2-(2-methoxyphenyl)pyrazol-3-yl]methanamine
CID 83881539
3-(chloromethyl)-1-(2-methoxyphenyl)-5-methylpyrazole
CID 82129618
2-[5-(4-methoxyphenyl)-1-methylpyrazol-3-yl]ethanamine
CID 82071880

Frequently Asked Questions

What is the IUPAC name of [1-(2-methoxyphenyl)-5-(4-methoxyphenyl)pyrazol-3-yl]methanamine?
The IUPAC name of [1-(2-methoxyphenyl)-5-(4-methoxyphenyl)pyrazol-3-yl]methanamine (CID 82071949) is [1-(2-methoxyphenyl)-5-(4-methoxyphenyl)pyrazol-3-yl]methanamine.
What is the SMILES notation for [1-(2-methoxyphenyl)-5-(4-methoxyphenyl)pyrazol-3-yl]methanamine?
The canonical SMILES for [1-(2-methoxyphenyl)-5-(4-methoxyphenyl)pyrazol-3-yl]methanamine is COc1ccc(-c2cc(CN)nn2-c2ccccc2OC)cc1.
What is the InChIKey of [1-(2-methoxyphenyl)-5-(4-methoxyphenyl)pyrazol-3-yl]methanamine?
The InChIKey is UIUCYCZCVOKJFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O2/c1-22-15-9-7-13(8-10-15)17-11-14(12-19)20-21(17)16-5-3-4-6-18(16)23-2/h3-11H,12,19H2,1-2H3.
What are the key properties of [1-(2-methoxyphenyl)-5-(4-methoxyphenyl)pyrazol-3-yl]methanamine?
[1-(2-methoxyphenyl)-5-(4-methoxyphenyl)pyrazol-3-yl]methanamine has a molecular weight of 309.37 g/mol, XLogP of 3.02, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-methoxyphenyl)-5-(4-methoxyphenyl)pyrazol-3-yl]methanamine is sourced from PubChem (CID 82071949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).