1-(2-methoxyphenyl)-4-[3-(1,2,3,4-tetrahydronaphthalen-1-yl)propyl]piperazine

C24H32N2O — CID 10067369

IUPAC1-(2-methoxyphenyl)-4-[3-(1,2,3,4-tetrahydronaphthalen-1-yl)propyl]piperazine
SMILESCOc1ccccc1N1CCN(CCCC2CCCc3ccccc32)CC1
InChIInChI=1S/C24H32N2O/c1-27-24-14-5-4-13-23(24)26-18-16-25(17-19-26)15-7-11-21-10-6-9-20-8-2-3-12-22(20)21/h2-5,8,12-14,21H,6-7,9-11,15-19H2,1H3
InChIKeyHIHMWBRIJRFADD-UHFFFAOYSA-N
MW364.53 g/mol
LogP4.72
Rot. Bonds6

About 1-(2-methoxyphenyl)-4-[3-(1,2,3,4-tetrahydronaphthalen-1-yl)propyl]piperazine

1-(2-methoxyphenyl)-4-[3-(1,2,3,4-tetrahydronaphthalen-1-yl)propyl]piperazine (PubChem CID 10067369) has the molecular formula C24H32N2O and a molecular weight of 364.53 g/mol. Its IUPAC name is 1-(2-methoxyphenyl)-4-[3-(1,2,3,4-tetrahydronaphthalen-1-yl)propyl]piperazine.

Molecular Properties

Compound Name1-(2-methoxyphenyl)-4-[3-(1,2,3,4-tetrahydronaphthalen-1-yl)propyl]piperazine
PubChem CID10067369
Molecular FormulaC24H32N2O
Molecular Weight364.53 g/mol
Exact Mass364.25
IUPAC Name1-(2-methoxyphenyl)-4-[3-(1,2,3,4-tetrahydronaphthalen-1-yl)propyl]piperazine
SMILESCOc1ccccc1N1CCN(CCCC2CCCc3ccccc32)CC1
InChIInChI=1S/C24H32N2O/c1-27-24-14-5-4-13-23(24)26-18-16-25(17-19-26)15-7-11-21-10-6-9-20-8-2-3-12-22(20)21/h2-5,8,12-14,21H,6-7,9-11,15-19H2,1H3
InChIKeyHIHMWBRIJRFADD-UHFFFAOYSA-N
XLogP4.72
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.53
LogP ≤ 54.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyphenyl)-4-[3-(1,2,3,4-tetrahydronaphthalen-1-yl)propyl]piperazine?
The IUPAC name of 1-(2-methoxyphenyl)-4-[3-(1,2,3,4-tetrahydronaphthalen-1-yl)propyl]piperazine (CID 10067369) is 1-(2-methoxyphenyl)-4-[3-(1,2,3,4-tetrahydronaphthalen-1-yl)propyl]piperazine.
What is the SMILES notation for 1-(2-methoxyphenyl)-4-[3-(1,2,3,4-tetrahydronaphthalen-1-yl)propyl]piperazine?
The canonical SMILES for 1-(2-methoxyphenyl)-4-[3-(1,2,3,4-tetrahydronaphthalen-1-yl)propyl]piperazine is COc1ccccc1N1CCN(CCCC2CCCc3ccccc32)CC1.
What is the InChIKey of 1-(2-methoxyphenyl)-4-[3-(1,2,3,4-tetrahydronaphthalen-1-yl)propyl]piperazine?
The InChIKey is HIHMWBRIJRFADD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H32N2O/c1-27-24-14-5-4-13-23(24)26-18-16-25(17-19-26)15-7-11-21-10-6-9-20-8-2-3-12-22(20)21/h2-5,8,12-14,21H,6-7,9-11,15-19H2,1H3.
What are the key properties of 1-(2-methoxyphenyl)-4-[3-(1,2,3,4-tetrahydronaphthalen-1-yl)propyl]piperazine?
1-(2-methoxyphenyl)-4-[3-(1,2,3,4-tetrahydronaphthalen-1-yl)propyl]piperazine has a molecular weight of 364.53 g/mol, XLogP of 4.72, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyphenyl)-4-[3-(1,2,3,4-tetrahydronaphthalen-1-yl)propyl]piperazine is sourced from PubChem (CID 10067369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).