1-[(2R)-1-(3,4-dimethoxyphenyl)propan-2-yl]-4-ethylpiperazine

C17H28N2O2 — CID 30982426

IUPAC1-[(2R)-1-(3,4-dimethoxyphenyl)propan-2-yl]-4-ethylpiperazine
SMILESCCN1CCN([C@H](C)Cc2ccc(OC)c(OC)c2)CC1
InChIInChI=1S/C17H28N2O2/c1-5-18-8-10-19(11-9-18)14(2)12-15-6-7-16(20-3)17(13-15)21-4/h6-7,13-14H,5,8-12H2,1-4H3/t14-/m1/s1
InChIKeyJBFJUOOURAGFLP-CQSZACIVSA-N
MW292.42 g/mol
LogP2.27
Rot. Bonds6

About 1-[(2R)-1-(3,4-dimethoxyphenyl)propan-2-yl]-4-ethylpiperazine

1-[(2R)-1-(3,4-dimethoxyphenyl)propan-2-yl]-4-ethylpiperazine (PubChem CID 30982426) has the molecular formula C17H28N2O2 and a molecular weight of 292.42 g/mol. Its IUPAC name is 1-[(2R)-1-(3,4-dimethoxyphenyl)propan-2-yl]-4-ethylpiperazine.

Molecular Properties

Compound Name1-[(2R)-1-(3,4-dimethoxyphenyl)propan-2-yl]-4-ethylpiperazine
PubChem CID30982426
Molecular FormulaC17H28N2O2
Molecular Weight292.42 g/mol
Exact Mass292.22
IUPAC Name1-[(2R)-1-(3,4-dimethoxyphenyl)propan-2-yl]-4-ethylpiperazine
SMILESCCN1CCN([C@H](C)Cc2ccc(OC)c(OC)c2)CC1
InChIInChI=1S/C17H28N2O2/c1-5-18-8-10-19(11-9-18)14(2)12-15-6-7-16(20-3)17(13-15)21-4/h6-7,13-14H,5,8-12H2,1-4H3/t14-/m1/s1
InChIKeyJBFJUOOURAGFLP-CQSZACIVSA-N
XLogP2.27
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.42
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-[(2R)-1-(3,4-dimethoxyphenyl)propan-2-yl]-4-ethylpiperazine 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

4-[(2S)-1-(3,4-dimethoxyphenyl)propan-2-yl]thiomorpholine
CID 30982621
3-(3,4-dimethoxyphenyl)-1-(4-ethylpiperazin-1-yl)-2-methylpropan-1-one
CID 84575608
1-[1-(3,4-dimethoxyphenyl)propan-2-yl]-4-(4-methoxy-3-methylphenyl)piperazine
CID 10134641
1-[(3,4-dimethoxyphenyl)methyl]-4-propan-2-ylpiperazine
CID 764481
1-[1-(3,4-dimethoxyphenyl)propan-2-yl]-4-(2,3-dimethylphenyl)piperazine
CID 2846456
1-[1-(3,4-dimethoxyphenyl)propan-2-yl]-4-methylpyrrolidin-3-amine
CID 103575485
ethyl 1-[1-(3,4-dimethoxyphenyl)propan-2-yl]piperidine-4-carboxylate
CID 23960975
1-[2-(3,4-dimethoxyphenyl)ethyl]-3-ethyl-2-[2-(4-ethylpiperazin-1-yl)propyl]guanidine;hydroiodide
CID 111213416
4-[(2R,3R)-4-(3,4-dimethoxyphenyl)-2,3-dimethylbutyl]-1,2-dimethoxybenzene
CID 515707
2-(4-ethylpiperazin-1-yl)-N-[[3-methoxy-4-(pyridin-4-ylmethoxy)phenyl]methyl]propan-1-amine
CID 119111210
4-(3-chloro-2-methylpentyl)-1,2-dimethoxybenzene
CID 79307803
2-methoxy-4-[(2R)-2-thiomorpholin-4-ylpropyl]phenol
CID 40514865

Frequently Asked Questions

What is the IUPAC name of 1-[(2R)-1-(3,4-dimethoxyphenyl)propan-2-yl]-4-ethylpiperazine?
The IUPAC name of 1-[(2R)-1-(3,4-dimethoxyphenyl)propan-2-yl]-4-ethylpiperazine (CID 30982426) is 1-[(2R)-1-(3,4-dimethoxyphenyl)propan-2-yl]-4-ethylpiperazine.
What is the SMILES notation for 1-[(2R)-1-(3,4-dimethoxyphenyl)propan-2-yl]-4-ethylpiperazine?
The canonical SMILES for 1-[(2R)-1-(3,4-dimethoxyphenyl)propan-2-yl]-4-ethylpiperazine is CCN1CCN([C@H](C)Cc2ccc(OC)c(OC)c2)CC1.
What is the InChIKey of 1-[(2R)-1-(3,4-dimethoxyphenyl)propan-2-yl]-4-ethylpiperazine?
The InChIKey is JBFJUOOURAGFLP-CQSZACIVSA-N. The full InChI is InChI=1S/C17H28N2O2/c1-5-18-8-10-19(11-9-18)14(2)12-15-6-7-16(20-3)17(13-15)21-4/h6-7,13-14H,5,8-12H2,1-4H3/t14-/m1/s1.
What are the key properties of 1-[(2R)-1-(3,4-dimethoxyphenyl)propan-2-yl]-4-ethylpiperazine?
1-[(2R)-1-(3,4-dimethoxyphenyl)propan-2-yl]-4-ethylpiperazine has a molecular weight of 292.42 g/mol, XLogP of 2.27, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2R)-1-(3,4-dimethoxyphenyl)propan-2-yl]-4-ethylpiperazine is sourced from PubChem (CID 30982426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).