3-(4-ethyl-2,5-dimethoxyphenyl)-1-methylpyrazol-5-amine

C14H19N3O2 — CID 117407814

IUPAC3-(4-ethyl-2,5-dimethoxyphenyl)-1-methylpyrazol-5-amine
SMILESCCc1cc(OC)c(-c2cc(N)n(C)n2)cc1OC
InChIInChI=1S/C14H19N3O2/c1-5-9-6-13(19-4)10(7-12(9)18-3)11-8-14(15)17(2)16-11/h6-8H,5,15H2,1-4H3
InChIKeyRGMWXIMFOOOBTM-UHFFFAOYSA-N
MW261.32 g/mol
LogP2.25
Rot. Bonds4

About 3-(4-ethyl-2,5-dimethoxyphenyl)-1-methylpyrazol-5-amine

3-(4-ethyl-2,5-dimethoxyphenyl)-1-methylpyrazol-5-amine (PubChem CID 117407814) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is 3-(4-ethyl-2,5-dimethoxyphenyl)-1-methylpyrazol-5-amine.

Molecular Properties

Compound Name3-(4-ethyl-2,5-dimethoxyphenyl)-1-methylpyrazol-5-amine
PubChem CID117407814
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC Name3-(4-ethyl-2,5-dimethoxyphenyl)-1-methylpyrazol-5-amine
SMILESCCc1cc(OC)c(-c2cc(N)n(C)n2)cc1OC
InChIInChI=1S/C14H19N3O2/c1-5-9-6-13(19-4)10(7-12(9)18-3)11-8-14(15)17(2)16-11/h6-8H,5,15H2,1-4H3
InChIKeyRGMWXIMFOOOBTM-UHFFFAOYSA-N
XLogP2.25
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(5-ethyl-4-fluoro-2-methoxyphenyl)-1-methylpyrazol-5-amine
CID 117375997
3-(5-chloro-2-ethyl-4-methoxyphenyl)-1-methylpyrazol-5-amine
CID 117418518
3-[4-(dimethylamino)-2,5-dimethoxyphenyl]-1-methylpyrazol-5-amine
CID 117442658
3-(3-chloro-5-ethyl-2,4-dimethoxyphenyl)-1-methylpyrazol-5-amine
CID 117476523
4-(5-amino-1-methylpyrazol-3-yl)-6-methoxy-2,3-dimethylphenol
CID 136997969
4-(5-amino-1-methylpyrazol-3-yl)-5-bromo-2-methoxyphenol
CID 136966320
3-(5-amino-1-methylpyrazol-3-yl)-4,5-dimethoxyphenol
CID 117375802
3-[2-(1,1-difluoroethyl)-4,5-dimethoxyphenyl]-1-methylpyrazol-5-amine
CID 117478815
6-(5-amino-1-methylpyrazol-3-yl)-5-methoxy-1,3-benzoxathiol-2-one
CID 117444116
3-(2,5-difluoro-3-methoxyphenyl)-1-methylpyrazol-5-amine
CID 117350204
methyl 3-(5-amino-1-methylpyrazol-3-yl)-4,5-dimethoxybenzoate
CID 117470471
3-(2-methoxy-5-methylsulfonylphenyl)-1-methylpyrazol-5-amine
CID 117451531

Frequently Asked Questions

What is the IUPAC name of 3-(4-ethyl-2,5-dimethoxyphenyl)-1-methylpyrazol-5-amine?
The IUPAC name of 3-(4-ethyl-2,5-dimethoxyphenyl)-1-methylpyrazol-5-amine (CID 117407814) is 3-(4-ethyl-2,5-dimethoxyphenyl)-1-methylpyrazol-5-amine.
What is the SMILES notation for 3-(4-ethyl-2,5-dimethoxyphenyl)-1-methylpyrazol-5-amine?
The canonical SMILES for 3-(4-ethyl-2,5-dimethoxyphenyl)-1-methylpyrazol-5-amine is CCc1cc(OC)c(-c2cc(N)n(C)n2)cc1OC.
What is the InChIKey of 3-(4-ethyl-2,5-dimethoxyphenyl)-1-methylpyrazol-5-amine?
The InChIKey is RGMWXIMFOOOBTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c1-5-9-6-13(19-4)10(7-12(9)18-3)11-8-14(15)17(2)16-11/h6-8H,5,15H2,1-4H3.
What are the key properties of 3-(4-ethyl-2,5-dimethoxyphenyl)-1-methylpyrazol-5-amine?
3-(4-ethyl-2,5-dimethoxyphenyl)-1-methylpyrazol-5-amine has a molecular weight of 261.32 g/mol, XLogP of 2.25, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-ethyl-2,5-dimethoxyphenyl)-1-methylpyrazol-5-amine is sourced from PubChem (CID 117407814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).