1-[2-(6-methoxynaphthalen-2-yl)propyl]-4-phenylpiperazine

C24H28N2O — CID 3055315

IUPAC1-[2-(6-methoxynaphthalen-2-yl)propyl]-4-phenylpiperazine
SMILESCOc1ccc2cc(C(C)CN3CCN(c4ccccc4)CC3)ccc2c1
InChIInChI=1S/C24H28N2O/c1-19(20-8-9-22-17-24(27-2)11-10-21(22)16-20)18-25-12-14-26(15-13-25)23-6-4-3-5-7-23/h3-11,16-17,19H,12-15,18H2,1-2H3
InChIKeyZMKYOJBMHGJESB-UHFFFAOYSA-N
MW360.50 g/mol
LogP4.77
Rot. Bonds5

About 1-[2-(6-methoxynaphthalen-2-yl)propyl]-4-phenylpiperazine

1-[2-(6-methoxynaphthalen-2-yl)propyl]-4-phenylpiperazine (PubChem CID 3055315) has the molecular formula C24H28N2O and a molecular weight of 360.50 g/mol. Its IUPAC name is 1-[2-(6-methoxynaphthalen-2-yl)propyl]-4-phenylpiperazine.

Molecular Properties

Compound Name1-[2-(6-methoxynaphthalen-2-yl)propyl]-4-phenylpiperazine
PubChem CID3055315
Molecular FormulaC24H28N2O
Molecular Weight360.50 g/mol
Exact Mass360.22
IUPAC Name1-[2-(6-methoxynaphthalen-2-yl)propyl]-4-phenylpiperazine
SMILESCOc1ccc2cc(C(C)CN3CCN(c4ccccc4)CC3)ccc2c1
InChIInChI=1S/C24H28N2O/c1-19(20-8-9-22-17-24(27-2)11-10-21(22)16-20)18-25-12-14-26(15-13-25)23-6-4-3-5-7-23/h3-11,16-17,19H,12-15,18H2,1-2H3
InChIKeyZMKYOJBMHGJESB-UHFFFAOYSA-N
XLogP4.77
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.50
LogP ≤ 54.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

Tolnaftate
CID 5510
5,6-Dihydro-1,2-dimethoxy-6-methyl-4H-dibenzo(de,g)quinoline
CID 821347
1-(2-Methoxy-phenyl)-4-[3-(1,2,3,4-tetrahydro-naphthalen-1-yl)-propyl]-piperazine
CID 10067369
1-[3-(5-Methoxy-1,2,3,4-tetrahydro-naphthalen-1-yl)-propyl]-4-phenyl-piperazine
CID 10361439
1-(2-Methoxy-phenyl)-4-[3-(5-methoxy-1,2,3,4-tetrahydro-naphthalen-1-yl)-propyl]-piperazine
CID 10385977
1-(7-Methoxynaphthalen-2-yl)piperazine
CID 44351692
4,4'-[(4-Methoxyphenyl)methylene]bis(N,N-dimethylaniline)
CID 348623
1-[(3E)-3-(5-methoxy-3,4-dihydro-2H-naphthalen-1-ylidene)propyl]-4-(2-methoxyphenyl)piperazine
CID 10475634
1-(2-Methoxyphenyl)-4-[4-(3-methoxyphenyl)cyclohexyl]piperazine
CID 10091187
4-(3-(1,2-Dihydro-6-methoxynaphthalen-4-yl)-n-propyl)-1-(2-methoxyphenyl)piperazine
CID 192638
4-(3-(1,2-Dihydro-8-methoxynaphthalen-4-yl)-n-propyl)-1-(2-pyridyl)piperazine
CID 192639
1-[3-(5-Methoxy-3,4-dihydro-naphthalen-1-yl)-propyl]-4-phenyl-piperazine
CID 10021562

Frequently Asked Questions

What is the IUPAC name of 1-[2-(6-methoxynaphthalen-2-yl)propyl]-4-phenylpiperazine?
The IUPAC name of 1-[2-(6-methoxynaphthalen-2-yl)propyl]-4-phenylpiperazine (CID 3055315) is 1-[2-(6-methoxynaphthalen-2-yl)propyl]-4-phenylpiperazine.
What is the SMILES notation for 1-[2-(6-methoxynaphthalen-2-yl)propyl]-4-phenylpiperazine?
The canonical SMILES for 1-[2-(6-methoxynaphthalen-2-yl)propyl]-4-phenylpiperazine is COc1ccc2cc(C(C)CN3CCN(c4ccccc4)CC3)ccc2c1.
What is the InChIKey of 1-[2-(6-methoxynaphthalen-2-yl)propyl]-4-phenylpiperazine?
The InChIKey is ZMKYOJBMHGJESB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N2O/c1-19(20-8-9-22-17-24(27-2)11-10-21(22)16-20)18-25-12-14-26(15-13-25)23-6-4-3-5-7-23/h3-11,16-17,19H,12-15,18H2,1-2H3.
What are the key properties of 1-[2-(6-methoxynaphthalen-2-yl)propyl]-4-phenylpiperazine?
1-[2-(6-methoxynaphthalen-2-yl)propyl]-4-phenylpiperazine has a molecular weight of 360.50 g/mol, XLogP of 4.77, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(6-methoxynaphthalen-2-yl)propyl]-4-phenylpiperazine is sourced from PubChem (CID 3055315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).