1-(4-methoxy-1-methylpyrazol-5-yl)-2-(2-methylphenyl)ethanamine

C14H19N3O — CID 114648841

IUPAC1-(4-methoxy-1-methylpyrazol-5-yl)-2-(2-methylphenyl)ethanamine
SMILESCOc1cnn(C)c1C(N)Cc1ccccc1C
InChIInChI=1S/C14H19N3O/c1-10-6-4-5-7-11(10)8-12(15)14-13(18-3)9-16-17(14)2/h4-7,9,12H,8,15H2,1-3H3
InChIKeyYTHDJDYVCQIFJL-UHFFFAOYSA-N
MW245.33 g/mol
LogP1.98
Rot. Bonds4

About 1-(4-methoxy-1-methylpyrazol-5-yl)-2-(2-methylphenyl)ethanamine

1-(4-methoxy-1-methylpyrazol-5-yl)-2-(2-methylphenyl)ethanamine (PubChem CID 114648841) has the molecular formula C14H19N3O and a molecular weight of 245.33 g/mol. Its IUPAC name is 1-(4-methoxy-1-methylpyrazol-5-yl)-2-(2-methylphenyl)ethanamine.

Molecular Properties

Compound Name1-(4-methoxy-1-methylpyrazol-5-yl)-2-(2-methylphenyl)ethanamine
PubChem CID114648841
Molecular FormulaC14H19N3O
Molecular Weight245.33 g/mol
Exact Mass245.15
IUPAC Name1-(4-methoxy-1-methylpyrazol-5-yl)-2-(2-methylphenyl)ethanamine
SMILESCOc1cnn(C)c1C(N)Cc1ccccc1C
InChIInChI=1S/C14H19N3O/c1-10-6-4-5-7-11(10)8-12(15)14-13(18-3)9-16-17(14)2/h4-7,9,12H,8,15H2,1-3H3
InChIKeyYTHDJDYVCQIFJL-UHFFFAOYSA-N
XLogP1.98
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-chlorophenyl)-1-(4-methoxy-1-methylpyrazol-5-yl)ethanamine
CID 114646649
(4-methoxy-1-methylpyrazol-5-yl)-(3-methyl-2-pyridinyl)methanamine
CID 114648978
1-(1-ethyl-4-methoxypyrazol-5-yl)-2-(2-methylphenyl)ethanol
CID 114643227
2-(2-bromophenyl)-1-(1-ethyl-4-methoxypyrazol-5-yl)ethanamine
CID 114650058
[2-(2-fluorophenyl)-1-(4-methoxy-1-methylpyrazol-5-yl)ethyl]hydrazine
CID 105206986
(1R)-1-(3,4-dimethoxyphenyl)-2-(2-methylphenyl)ethanamine
CID 42058451
1-(4-methoxy-1-methylpyrazol-5-yl)hexan-1-amine
CID 105047246
1-(4-methoxy-1-methylpyrazol-5-yl)-2-naphthalen-1-ylethanol
CID 105130023
1-(4-bromo-1-propylpyrazol-5-yl)-2-(2-methylphenyl)ethanamine
CID 114648837
[1-(4-methoxy-1-methylpyrazol-5-yl)-2-phenylethyl]hydrazine
CID 105195307
1-(4-methoxy-1-methylpyrazol-5-yl)-2-phenylbutan-1-amine
CID 105047114
(4-methoxy-3-methylphenyl)-(4-methoxy-1-methylpyrazol-5-yl)methanamine
CID 114659334

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxy-1-methylpyrazol-5-yl)-2-(2-methylphenyl)ethanamine?
The IUPAC name of 1-(4-methoxy-1-methylpyrazol-5-yl)-2-(2-methylphenyl)ethanamine (CID 114648841) is 1-(4-methoxy-1-methylpyrazol-5-yl)-2-(2-methylphenyl)ethanamine.
What is the SMILES notation for 1-(4-methoxy-1-methylpyrazol-5-yl)-2-(2-methylphenyl)ethanamine?
The canonical SMILES for 1-(4-methoxy-1-methylpyrazol-5-yl)-2-(2-methylphenyl)ethanamine is COc1cnn(C)c1C(N)Cc1ccccc1C.
What is the InChIKey of 1-(4-methoxy-1-methylpyrazol-5-yl)-2-(2-methylphenyl)ethanamine?
The InChIKey is YTHDJDYVCQIFJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O/c1-10-6-4-5-7-11(10)8-12(15)14-13(18-3)9-16-17(14)2/h4-7,9,12H,8,15H2,1-3H3.
What are the key properties of 1-(4-methoxy-1-methylpyrazol-5-yl)-2-(2-methylphenyl)ethanamine?
1-(4-methoxy-1-methylpyrazol-5-yl)-2-(2-methylphenyl)ethanamine has a molecular weight of 245.33 g/mol, XLogP of 1.98, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxy-1-methylpyrazol-5-yl)-2-(2-methylphenyl)ethanamine is sourced from PubChem (CID 114648841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).