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

C14H19N3O — CID 62126855

IUPAC2-[2-[(1-ethylpyrazol-4-yl)methoxy]phenyl]ethanamine
SMILESCCn1cc(COc2ccccc2CCN)cn1
InChIInChI=1S/C14H19N3O/c1-2-17-10-12(9-16-17)11-18-14-6-4-3-5-13(14)7-8-15/h3-6,9-10H,2,7-8,11,15H2,1H3
InChIKeyQBNFEBREQJUIIB-UHFFFAOYSA-N
MW245.33 g/mol
LogP1.98
Rot. Bonds6

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

2-[2-[(1-ethylpyrazol-4-yl)methoxy]phenyl]ethanamine (PubChem CID 62126855) has the molecular formula C14H19N3O and a molecular weight of 245.33 g/mol. Its IUPAC name is 2-[2-[(1-ethylpyrazol-4-yl)methoxy]phenyl]ethanamine.

Molecular Properties

Compound Name2-[2-[(1-ethylpyrazol-4-yl)methoxy]phenyl]ethanamine
PubChem CID62126855
Molecular FormulaC14H19N3O
Molecular Weight245.33 g/mol
Exact Mass245.15
IUPAC Name2-[2-[(1-ethylpyrazol-4-yl)methoxy]phenyl]ethanamine
SMILESCCn1cc(COc2ccccc2CCN)cn1
InChIInChI=1S/C14H19N3O/c1-2-17-10-12(9-16-17)11-18-14-6-4-3-5-13(14)7-8-15/h3-6,9-10H,2,7-8,11,15H2,1H3
InChIKeyQBNFEBREQJUIIB-UHFFFAOYSA-N
XLogP1.98
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
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

Analyze 2-[2-[(1-ethylpyrazol-4-yl)methoxy]phenyl]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-[2-[(1-ethylpyrazol-4-yl)methoxy]phenyl]-N-methylmethanamine
CID 62126496
1-ethyl-4-[(2-fluorophenoxy)methyl]pyrazole
CID 64766010
(1S)-1-[2-[(1-ethylpyrazol-4-yl)methoxy]phenyl]ethanamine
CID 78936450
[2-[(1-ethylpyrazol-4-yl)methoxy]phenyl]-trifluoroboranuide
CID 63677026
1-[2-[(1-ethylpyrazol-4-yl)methoxy]phenyl]-N-methylethanamine
CID 62125623
3-[(1-ethylpyrazol-4-yl)methoxy]naphthalen-2-ol
CID 62125688
[2-[(1-ethylpyrazol-4-yl)methoxy]-3-methoxyphenyl]methanol
CID 62127791
1-[2-[(1-ethylpyrazol-4-yl)methoxy]phenyl]-N-methylpropan-1-amine
CID 62128091
1-[2-[(1-ethylpyrazol-4-yl)methoxy]-5-fluorophenyl]butan-2-amine
CID 107701248
4-[(1-ethylpyrazol-4-yl)methoxy]-2,5-difluoroaniline
CID 63600050
2-chloro-6-[(1-ethylpyrazol-4-yl)methoxy]benzenecarbothioamide
CID 114322950
1-[2-[(1-ethylpyrazol-4-yl)methoxy]-3-methoxyphenyl]-N-methylmethanamine
CID 62126144

Frequently Asked Questions

What is the IUPAC name of 2-[2-[(1-ethylpyrazol-4-yl)methoxy]phenyl]ethanamine?
The IUPAC name of 2-[2-[(1-ethylpyrazol-4-yl)methoxy]phenyl]ethanamine (CID 62126855) is 2-[2-[(1-ethylpyrazol-4-yl)methoxy]phenyl]ethanamine.
What is the SMILES notation for 2-[2-[(1-ethylpyrazol-4-yl)methoxy]phenyl]ethanamine?
The canonical SMILES for 2-[2-[(1-ethylpyrazol-4-yl)methoxy]phenyl]ethanamine is CCn1cc(COc2ccccc2CCN)cn1.
What is the InChIKey of 2-[2-[(1-ethylpyrazol-4-yl)methoxy]phenyl]ethanamine?
The InChIKey is QBNFEBREQJUIIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O/c1-2-17-10-12(9-16-17)11-18-14-6-4-3-5-13(14)7-8-15/h3-6,9-10H,2,7-8,11,15H2,1H3.
What are the key properties of 2-[2-[(1-ethylpyrazol-4-yl)methoxy]phenyl]ethanamine?
2-[2-[(1-ethylpyrazol-4-yl)methoxy]phenyl]ethanamine has a molecular weight of 245.33 g/mol, XLogP of 1.98, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(1-ethylpyrazol-4-yl)methoxy]phenyl]ethanamine is sourced from PubChem (CID 62126855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).