1-(4-methoxyphenyl)-2-(1-pyrazol-1-ylpropan-2-ylamino)ethanol

C15H21N3O2 — CID 56828855

IUPAC1-(4-methoxyphenyl)-2-(1-pyrazol-1-ylpropan-2-ylamino)ethanol
SMILESCOc1ccc(C(O)CNC(C)Cn2cccn2)cc1
InChIInChI=1S/C15H21N3O2/c1-12(11-18-9-3-8-17-18)16-10-15(19)13-4-6-14(20-2)7-5-13/h3-9,12,15-16,19H,10-11H2,1-2H3
InChIKeyNNNXPMNCCBGJGZ-UHFFFAOYSA-N
MW275.35 g/mol
LogP1.60
Rot. Bonds7

About 1-(4-methoxyphenyl)-2-(1-pyrazol-1-ylpropan-2-ylamino)ethanol

1-(4-methoxyphenyl)-2-(1-pyrazol-1-ylpropan-2-ylamino)ethanol (PubChem CID 56828855) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)-2-(1-pyrazol-1-ylpropan-2-ylamino)ethanol.

Molecular Properties

Compound Name1-(4-methoxyphenyl)-2-(1-pyrazol-1-ylpropan-2-ylamino)ethanol
PubChem CID56828855
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC Name1-(4-methoxyphenyl)-2-(1-pyrazol-1-ylpropan-2-ylamino)ethanol
SMILESCOc1ccc(C(O)CNC(C)Cn2cccn2)cc1
InChIInChI=1S/C15H21N3O2/c1-12(11-18-9-3-8-17-18)16-10-15(19)13-4-6-14(20-2)7-5-13/h3-9,12,15-16,19H,10-11H2,1-2H3
InChIKeyNNNXPMNCCBGJGZ-UHFFFAOYSA-N
XLogP1.60
TPSA59.31 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 1-(4-methoxyphenyl)-2-(1-pyrazol-1-ylpropan-2-ylamino)ethanol 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-[[(1R)-1-(4-methoxyphenyl)ethyl]amino]-3-pyrazol-1-ylpropan-2-ol
CID 81371484
2-(butan-2-ylamino)-1-(4-methoxyphenyl)ethanol
CID 60904151
1-(4-methoxyphenyl)-N-(1-pyrazol-1-ylpropan-2-yl)propan-1-amine
CID 43749281
1-(2-chlorophenyl)-2-(1-pyrazol-1-ylpropan-2-ylamino)ethanol
CID 61459886
2-(1-imidazol-1-ylpropan-2-ylamino)-1-(3-methoxyphenyl)ethanol
CID 81133447
1-(1-pyrazol-1-ylpropan-2-ylamino)butan-2-ol
CID 61462811
(1R)-1-(4-methoxyphenyl)-N-(2-pyrazol-1-ylethyl)ethanamine
CID 81370767
(2S)-N-[(2,4-dimethoxyphenyl)methyl]-1-pyrazol-1-ylpropan-2-amine
CID 93046419
(1R)-1-(2,5-difluorophenyl)-2-[[(2S)-1-pyrazol-1-ylpropan-2-yl]amino]ethanol
CID 94200232
(1R)-1-(2,5-difluorophenyl)-2-[[(2R)-1-pyrazol-1-ylpropan-2-yl]amino]ethanol
CID 94200233
2-(4-methoxyphenyl)-3-pyrazol-1-ylpropan-1-amine
CID 115038406
1-(4-methoxyphenyl)-2-(1-phenylethylamino)ethanol
CID 60766376

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)-2-(1-pyrazol-1-ylpropan-2-ylamino)ethanol?
The IUPAC name of 1-(4-methoxyphenyl)-2-(1-pyrazol-1-ylpropan-2-ylamino)ethanol (CID 56828855) is 1-(4-methoxyphenyl)-2-(1-pyrazol-1-ylpropan-2-ylamino)ethanol.
What is the SMILES notation for 1-(4-methoxyphenyl)-2-(1-pyrazol-1-ylpropan-2-ylamino)ethanol?
The canonical SMILES for 1-(4-methoxyphenyl)-2-(1-pyrazol-1-ylpropan-2-ylamino)ethanol is COc1ccc(C(O)CNC(C)Cn2cccn2)cc1.
What is the InChIKey of 1-(4-methoxyphenyl)-2-(1-pyrazol-1-ylpropan-2-ylamino)ethanol?
The InChIKey is NNNXPMNCCBGJGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c1-12(11-18-9-3-8-17-18)16-10-15(19)13-4-6-14(20-2)7-5-13/h3-9,12,15-16,19H,10-11H2,1-2H3.
What are the key properties of 1-(4-methoxyphenyl)-2-(1-pyrazol-1-ylpropan-2-ylamino)ethanol?
1-(4-methoxyphenyl)-2-(1-pyrazol-1-ylpropan-2-ylamino)ethanol has a molecular weight of 275.35 g/mol, XLogP of 1.60, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)-2-(1-pyrazol-1-ylpropan-2-ylamino)ethanol is sourced from PubChem (CID 56828855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).