1-[2-[(1-ethylpyrazol-4-yl)methoxy]phenyl]-N-methylethanamine

C15H21N3O — CID 62125623

IUPAC1-[2-[(1-ethylpyrazol-4-yl)methoxy]phenyl]-N-methylethanamine
SMILESCCn1cc(COc2ccccc2C(C)NC)cn1
InChIInChI=1S/C15H21N3O/c1-4-18-10-13(9-17-18)11-19-15-8-6-5-7-14(15)12(2)16-3/h5-10,12,16H,4,11H2,1-3H3
InChIKeyCLJJWCILMSJNBD-UHFFFAOYSA-N
MW259.35 g/mol
LogP2.76
Rot. Bonds6

About 1-[2-[(1-ethylpyrazol-4-yl)methoxy]phenyl]-N-methylethanamine

1-[2-[(1-ethylpyrazol-4-yl)methoxy]phenyl]-N-methylethanamine (PubChem CID 62125623) has the molecular formula C15H21N3O and a molecular weight of 259.35 g/mol. Its IUPAC name is 1-[2-[(1-ethylpyrazol-4-yl)methoxy]phenyl]-N-methylethanamine.

Molecular Properties

Compound Name1-[2-[(1-ethylpyrazol-4-yl)methoxy]phenyl]-N-methylethanamine
PubChem CID62125623
Molecular FormulaC15H21N3O
Molecular Weight259.35 g/mol
Exact Mass259.17
IUPAC Name1-[2-[(1-ethylpyrazol-4-yl)methoxy]phenyl]-N-methylethanamine
SMILESCCn1cc(COc2ccccc2C(C)NC)cn1
InChIInChI=1S/C15H21N3O/c1-4-18-10-13(9-17-18)11-19-15-8-6-5-7-14(15)12(2)16-3/h5-10,12,16H,4,11H2,1-3H3
InChIKeyCLJJWCILMSJNBD-UHFFFAOYSA-N
XLogP2.76
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[2-[(1-ethylpyrazol-4-yl)methoxy]phenyl]-N-methylethanamine 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-[2-[(1-ethylpyrazol-4-yl)methoxy]phenyl]-N-methylpropan-1-amine
CID 62128091
(1S)-1-[2-[(1-ethylpyrazol-4-yl)methoxy]phenyl]ethanamine
CID 78936450
1-[2-[(1-ethylpyrazol-4-yl)methoxy]phenyl]-N-methylmethanamine
CID 62126496
1-ethyl-4-[(2-fluorophenoxy)methyl]pyrazole
CID 64766010
1-[3-[(1-ethylpyrazol-4-yl)methoxy]phenyl]-N-methylethanamine
CID 62125799
[2-[(1-ethylpyrazol-4-yl)methoxy]phenyl]-trifluoroboranuide
CID 63677026
2-[2-[(1-ethylpyrazol-4-yl)methoxy]phenyl]ethanamine
CID 62126855
(1S)-1-[2-[(1-ethylpyrazol-4-yl)methoxy]-5-methylphenyl]ethanamine
CID 78936430
(1S)-1-[2-[(1-ethylpyrazol-4-yl)methoxy]-5-methylphenyl]ethanol
CID 63366486
(1R)-1-[5-bromo-2-[(1-ethylpyrazol-4-yl)methoxy]phenyl]ethanol
CID 63365906
N-methyl-1-[2-[(3-methylphenyl)methoxy]phenyl]ethanamine
CID 43279574
3-[(1-ethylpyrazol-4-yl)methoxy]naphthalen-2-ol
CID 62125688

Frequently Asked Questions

What is the IUPAC name of 1-[2-[(1-ethylpyrazol-4-yl)methoxy]phenyl]-N-methylethanamine?
The IUPAC name of 1-[2-[(1-ethylpyrazol-4-yl)methoxy]phenyl]-N-methylethanamine (CID 62125623) is 1-[2-[(1-ethylpyrazol-4-yl)methoxy]phenyl]-N-methylethanamine.
What is the SMILES notation for 1-[2-[(1-ethylpyrazol-4-yl)methoxy]phenyl]-N-methylethanamine?
The canonical SMILES for 1-[2-[(1-ethylpyrazol-4-yl)methoxy]phenyl]-N-methylethanamine is CCn1cc(COc2ccccc2C(C)NC)cn1.
What is the InChIKey of 1-[2-[(1-ethylpyrazol-4-yl)methoxy]phenyl]-N-methylethanamine?
The InChIKey is CLJJWCILMSJNBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O/c1-4-18-10-13(9-17-18)11-19-15-8-6-5-7-14(15)12(2)16-3/h5-10,12,16H,4,11H2,1-3H3.
What are the key properties of 1-[2-[(1-ethylpyrazol-4-yl)methoxy]phenyl]-N-methylethanamine?
1-[2-[(1-ethylpyrazol-4-yl)methoxy]phenyl]-N-methylethanamine has a molecular weight of 259.35 g/mol, XLogP of 2.76, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[(1-ethylpyrazol-4-yl)methoxy]phenyl]-N-methylethanamine is sourced from PubChem (CID 62125623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).