1-[1-(2-methoxyphenyl)pyrazol-4-yl]oxy-N-methylpropan-2-amine

C14H19N3O2 — CID 117230222

IUPAC1-[1-(2-methoxyphenyl)pyrazol-4-yl]oxy-N-methylpropan-2-amine
SMILESCNC(C)COc1cnn(-c2ccccc2OC)c1
InChIInChI=1S/C14H19N3O2/c1-11(15-2)10-19-12-8-16-17(9-12)13-6-4-5-7-14(13)18-3/h4-9,11,15H,10H2,1-3H3
InChIKeyWLFXKQOOZNNPRS-UHFFFAOYSA-N
MW261.33 g/mol
LogP1.87
Rot. Bonds6

About 1-[1-(2-methoxyphenyl)pyrazol-4-yl]oxy-N-methylpropan-2-amine

1-[1-(2-methoxyphenyl)pyrazol-4-yl]oxy-N-methylpropan-2-amine (PubChem CID 117230222) has the molecular formula C14H19N3O2 and a molecular weight of 261.33 g/mol. Its IUPAC name is 1-[1-(2-methoxyphenyl)pyrazol-4-yl]oxy-N-methylpropan-2-amine.

Molecular Properties

Compound Name1-[1-(2-methoxyphenyl)pyrazol-4-yl]oxy-N-methylpropan-2-amine
PubChem CID117230222
Molecular FormulaC14H19N3O2
Molecular Weight261.33 g/mol
Exact Mass261.15
IUPAC Name1-[1-(2-methoxyphenyl)pyrazol-4-yl]oxy-N-methylpropan-2-amine
SMILESCNC(C)COc1cnn(-c2ccccc2OC)c1
InChIInChI=1S/C14H19N3O2/c1-11(15-2)10-19-12-8-16-17(9-12)13-6-4-5-7-14(13)18-3/h4-9,11,15H,10H2,1-3H3
InChIKeyWLFXKQOOZNNPRS-UHFFFAOYSA-N
XLogP1.87
TPSA48.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.33
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[1-(2-methoxyphenyl)pyrazol-4-yl]oxy-N-methylethanamine
CID 117230198
1-(2-methoxyphenyl)-4-propan-2-yloxypyrazole
CID 117229659
1-[1-(3-bromophenyl)pyrazol-4-yl]oxy-N-methylpropan-2-amine
CID 117230376
1-(2-methoxyphenyl)pyrazol-4-ol
CID 117124800
methyl N-[1-[[1-(2-methoxyphenyl)pyrazol-4-yl]methylamino]-1-oxopropan-2-yl]carbamate
CID 90649934
1-(2-methoxyphenyl)-N-[(2S)-1-(1,3-thiazol-5-yl)propan-2-yl]pyrazole-4-carboxamide
CID 97143423
2-(4-methoxypyrazol-1-yl)aniline
CID 130511077
3-[(1S)-1-[1-(2-methoxyphenyl)pyrazol-4-yl]ethyl]-1-methyl-1-[(3-methyloxetan-3-yl)methyl]urea
CID 125436564
(3R)-N-[[1-(2-methoxyphenyl)pyrazol-4-yl]methyl]thiolan-3-amine
CID 95149374
1-cyclobutyl-3-[(1S)-1-[1-(2-methoxyphenyl)pyrazol-4-yl]ethyl]urea
CID 125443355
8-methoxy-3-[[1-(2-methoxyphenyl)pyrazol-4-yl]methyl]-3-azabicyclo[3.2.1]octane
CID 156609533
1-[1-[1-(2-methoxyphenyl)pyrazol-4-yl]sulfonylpiperidin-4-yl]-N-methylmethanamine
CID 119978577

Frequently Asked Questions

What is the IUPAC name of 1-[1-(2-methoxyphenyl)pyrazol-4-yl]oxy-N-methylpropan-2-amine?
The IUPAC name of 1-[1-(2-methoxyphenyl)pyrazol-4-yl]oxy-N-methylpropan-2-amine (CID 117230222) is 1-[1-(2-methoxyphenyl)pyrazol-4-yl]oxy-N-methylpropan-2-amine.
What is the SMILES notation for 1-[1-(2-methoxyphenyl)pyrazol-4-yl]oxy-N-methylpropan-2-amine?
The canonical SMILES for 1-[1-(2-methoxyphenyl)pyrazol-4-yl]oxy-N-methylpropan-2-amine is CNC(C)COc1cnn(-c2ccccc2OC)c1.
What is the InChIKey of 1-[1-(2-methoxyphenyl)pyrazol-4-yl]oxy-N-methylpropan-2-amine?
The InChIKey is WLFXKQOOZNNPRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c1-11(15-2)10-19-12-8-16-17(9-12)13-6-4-5-7-14(13)18-3/h4-9,11,15H,10H2,1-3H3.
What are the key properties of 1-[1-(2-methoxyphenyl)pyrazol-4-yl]oxy-N-methylpropan-2-amine?
1-[1-(2-methoxyphenyl)pyrazol-4-yl]oxy-N-methylpropan-2-amine has a molecular weight of 261.33 g/mol, XLogP of 1.87, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(2-methoxyphenyl)pyrazol-4-yl]oxy-N-methylpropan-2-amine is sourced from PubChem (CID 117230222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).