1-[(1R)-1-(5-chloro-2-methoxyphenyl)pentyl]piperazine

C16H25ClN2O — CID 171308385

IUPAC1-[(1R)-1-(5-chloro-2-methoxyphenyl)pentyl]piperazine
SMILESCCCC[C@H](c1cc(Cl)ccc1OC)N1CCNCC1
InChIInChI=1S/C16H25ClN2O/c1-3-4-5-15(19-10-8-18-9-11-19)14-12-13(17)6-7-16(14)20-2/h6-7,12,15,18H,3-5,8-11H2,1-2H3/t15-/m1/s1
InChIKeyFOGUPTFQJKENCS-OAHLLOKOSA-N
MW296.84 g/mol
LogP3.49
Rot. Bonds6

About 1-[(1R)-1-(5-chloro-2-methoxyphenyl)pentyl]piperazine

1-[(1R)-1-(5-chloro-2-methoxyphenyl)pentyl]piperazine (PubChem CID 171308385) has the molecular formula C16H25ClN2O and a molecular weight of 296.84 g/mol. Its IUPAC name is 1-[(1R)-1-(5-chloro-2-methoxyphenyl)pentyl]piperazine.

Molecular Properties

Compound Name1-[(1R)-1-(5-chloro-2-methoxyphenyl)pentyl]piperazine
PubChem CID171308385
Molecular FormulaC16H25ClN2O
Molecular Weight296.84 g/mol
Exact Mass296.17
IUPAC Name1-[(1R)-1-(5-chloro-2-methoxyphenyl)pentyl]piperazine
SMILESCCCC[C@H](c1cc(Cl)ccc1OC)N1CCNCC1
InChIInChI=1S/C16H25ClN2O/c1-3-4-5-15(19-10-8-18-9-11-19)14-12-13(17)6-7-16(14)20-2/h6-7,12,15,18H,3-5,8-11H2,1-2H3/t15-/m1/s1
InChIKeyFOGUPTFQJKENCS-OAHLLOKOSA-N
XLogP3.49
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.84
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[(1R)-1-(5-chloro-2-methoxyphenyl)pentyl]piperazine 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

(3S)-3-(5-chloro-2-methoxyphenyl)-3-piperazin-1-ylpropan-1-ol
CID 95486981
1-[(1R)-1-(2,5-dimethoxyphenyl)pentyl]piperazine
CID 171307438
1-[(1S)-1-(5-fluoro-2-methoxyphenyl)pentyl]piperazine;hydrochloride
CID 171164755
1-[(1R)-1-(2,4,5-trimethoxyphenyl)pentyl]piperazine
CID 171307378
1-[(1S)-1-(2-chloro-3,4-dimethoxyphenyl)pentyl]piperazine
CID 171308877
1-[(1S)-1-(5-chloro-2-methoxyphenyl)pent-4-enyl]piperazine;dihydrochloride
CID 171283386
1-[1-(2,4-dichlorophenyl)pentyl]piperazine
CID 5226884
4-chloro-2-[(1R)-1-piperazin-1-ylpentyl]phenol;dihydrochloride
CID 171307229
1-[(1R)-1-(2-methoxy-5-propan-2-ylphenyl)hexyl]piperazine;dihydrochloride
CID 171308476
1-[(1R)-1-(5-chloro-2-methoxyphenyl)but-3-enyl]piperazine;dihydrochloride
CID 171295988
1-[(1R)-1-(5-chloro-2-methoxyphenyl)-3-methylbut-3-enyl]piperazine;dihydrochloride
CID 171296008
1-[(1S)-1-(3-fluoro-4-methoxyphenyl)pentyl]piperazine
CID 171163686

Frequently Asked Questions

What is the IUPAC name of 1-[(1R)-1-(5-chloro-2-methoxyphenyl)pentyl]piperazine?
The IUPAC name of 1-[(1R)-1-(5-chloro-2-methoxyphenyl)pentyl]piperazine (CID 171308385) is 1-[(1R)-1-(5-chloro-2-methoxyphenyl)pentyl]piperazine.
What is the SMILES notation for 1-[(1R)-1-(5-chloro-2-methoxyphenyl)pentyl]piperazine?
The canonical SMILES for 1-[(1R)-1-(5-chloro-2-methoxyphenyl)pentyl]piperazine is CCCC[C@H](c1cc(Cl)ccc1OC)N1CCNCC1.
What is the InChIKey of 1-[(1R)-1-(5-chloro-2-methoxyphenyl)pentyl]piperazine?
The InChIKey is FOGUPTFQJKENCS-OAHLLOKOSA-N. The full InChI is InChI=1S/C16H25ClN2O/c1-3-4-5-15(19-10-8-18-9-11-19)14-12-13(17)6-7-16(14)20-2/h6-7,12,15,18H,3-5,8-11H2,1-2H3/t15-/m1/s1.
What are the key properties of 1-[(1R)-1-(5-chloro-2-methoxyphenyl)pentyl]piperazine?
1-[(1R)-1-(5-chloro-2-methoxyphenyl)pentyl]piperazine has a molecular weight of 296.84 g/mol, XLogP of 3.49, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1R)-1-(5-chloro-2-methoxyphenyl)pentyl]piperazine is sourced from PubChem (CID 171308385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).