2-(3-methoxyphenyl)-1-(1-methylpyrazol-3-yl)ethanamine

C13H17N3O — CID 65200559

IUPAC2-(3-methoxyphenyl)-1-(1-methylpyrazol-3-yl)ethanamine
SMILESCOc1cccc(CC(N)c2ccn(C)n2)c1
InChIInChI=1S/C13H17N3O/c1-16-7-6-13(15-16)12(14)9-10-4-3-5-11(8-10)17-2/h3-8,12H,9,14H2,1-2H3
InChIKeyFYOWNAOYWGOTMU-UHFFFAOYSA-N
MW231.30 g/mol
LogP1.67
Rot. Bonds4

About 2-(3-methoxyphenyl)-1-(1-methylpyrazol-3-yl)ethanamine

2-(3-methoxyphenyl)-1-(1-methylpyrazol-3-yl)ethanamine (PubChem CID 65200559) has the molecular formula C13H17N3O and a molecular weight of 231.30 g/mol. Its IUPAC name is 2-(3-methoxyphenyl)-1-(1-methylpyrazol-3-yl)ethanamine.

Molecular Properties

Compound Name2-(3-methoxyphenyl)-1-(1-methylpyrazol-3-yl)ethanamine
PubChem CID65200559
Molecular FormulaC13H17N3O
Molecular Weight231.30 g/mol
Exact Mass231.14
IUPAC Name2-(3-methoxyphenyl)-1-(1-methylpyrazol-3-yl)ethanamine
SMILESCOc1cccc(CC(N)c2ccn(C)n2)c1
InChIInChI=1S/C13H17N3O/c1-16-7-6-13(15-16)12(14)9-10-4-3-5-11(8-10)17-2/h3-8,12H,9,14H2,1-2H3
InChIKeyFYOWNAOYWGOTMU-UHFFFAOYSA-N
XLogP1.67
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(3-methoxyphenyl)-1-(1-methylpyrazol-3-yl)ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[1-(3-methoxyphenyl)-3-(1-methylpyrazol-3-yl)propan-2-yl]hydrazine
CID 105205197
(1S)-1,2-bis(3-methoxyphenyl)ethanamine
CID 40618709
2-(6-methoxy-3-pyridinyl)-1-(1-methylpyrazol-3-yl)ethanamine
CID 103131183
1-chloro-2-(3-methoxyphenyl)ethanamine
CID 67681258
2-(3-methoxyphenyl)-1-pyrimidin-2-ylethanamine
CID 62600114
1,2-bis(3-methoxyphenyl)ethanamine;hydrochloride
CID 54599738
2-(3-methoxyphenyl)-1-(2,3,5,6-tetramethylphenyl)ethanamine
CID 43110626
2-(3-methoxyphenyl)-1-pyridin-3-ylethanamine
CID 22299530
2-(3-methoxyphenyl)-1-(2,4,6-trimethylphenyl)ethanamine
CID 43197699
4-(3-methoxyphenyl)-3-methylbutan-2-amine
CID 60995099
2-(3-methoxyphenyl)-1-(3-propyltriazol-4-yl)ethanamine
CID 114687287
2-(3-methoxyphenyl)-1-[4-(2-methylpropyl)phenyl]ethanamine
CID 43095852

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyphenyl)-1-(1-methylpyrazol-3-yl)ethanamine?
The IUPAC name of 2-(3-methoxyphenyl)-1-(1-methylpyrazol-3-yl)ethanamine (CID 65200559) is 2-(3-methoxyphenyl)-1-(1-methylpyrazol-3-yl)ethanamine.
What is the SMILES notation for 2-(3-methoxyphenyl)-1-(1-methylpyrazol-3-yl)ethanamine?
The canonical SMILES for 2-(3-methoxyphenyl)-1-(1-methylpyrazol-3-yl)ethanamine is COc1cccc(CC(N)c2ccn(C)n2)c1.
What is the InChIKey of 2-(3-methoxyphenyl)-1-(1-methylpyrazol-3-yl)ethanamine?
The InChIKey is FYOWNAOYWGOTMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O/c1-16-7-6-13(15-16)12(14)9-10-4-3-5-11(8-10)17-2/h3-8,12H,9,14H2,1-2H3.
What are the key properties of 2-(3-methoxyphenyl)-1-(1-methylpyrazol-3-yl)ethanamine?
2-(3-methoxyphenyl)-1-(1-methylpyrazol-3-yl)ethanamine has a molecular weight of 231.30 g/mol, XLogP of 1.67, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyphenyl)-1-(1-methylpyrazol-3-yl)ethanamine is sourced from PubChem (CID 65200559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).