4-(2-methoxyphenyl)-1-(naphthalen-1-ylmethyl)piperidine

C23H25NO — CID 2802698

IUPAC4-(2-methoxyphenyl)-1-(naphthalen-1-ylmethyl)piperidine
SMILESCOc1ccccc1C1CCN(Cc2cccc3ccccc23)CC1
InChIInChI=1S/C23H25NO/c1-25-23-12-5-4-11-22(23)19-13-15-24(16-14-19)17-20-9-6-8-18-7-2-3-10-21(18)20/h2-12,19H,13-17H2,1H3
InChIKeySWZOJTTWVCZKTG-UHFFFAOYSA-N
MW331.46 g/mol
LogP5.23
Rot. Bonds4

About 4-(2-methoxyphenyl)-1-(naphthalen-1-ylmethyl)piperidine

4-(2-methoxyphenyl)-1-(naphthalen-1-ylmethyl)piperidine (PubChem CID 2802698) has the molecular formula C23H25NO and a molecular weight of 331.46 g/mol. Its IUPAC name is 4-(2-methoxyphenyl)-1-(naphthalen-1-ylmethyl)piperidine.

Molecular Properties

Compound Name4-(2-methoxyphenyl)-1-(naphthalen-1-ylmethyl)piperidine
PubChem CID2802698
Molecular FormulaC23H25NO
Molecular Weight331.46 g/mol
Exact Mass331.19
IUPAC Name4-(2-methoxyphenyl)-1-(naphthalen-1-ylmethyl)piperidine
SMILESCOc1ccccc1C1CCN(Cc2cccc3ccccc23)CC1
InChIInChI=1S/C23H25NO/c1-25-23-12-5-4-11-22(23)19-13-15-24(16-14-19)17-20-9-6-8-18-7-2-3-10-21(18)20/h2-12,19H,13-17H2,1H3
InChIKeySWZOJTTWVCZKTG-UHFFFAOYSA-N
XLogP5.23
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500331.46
LogP ≤ 55.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-(2-methoxyphenyl)-1-propylpiperidine
CID 71653734
4-(2-methoxyphenyl)-1-[(3-methyl-1-benzothiophen-2-yl)methyl]piperidine
CID 2813359
1,4-bis(naphthalen-1-ylmethyl)piperazine
CID 4846171
(2,6-dimethoxyphenyl)-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]methanone
CID 1112837
[4-(2-methoxyphenyl)piperazin-1-yl]-[1-(naphthalen-1-ylmethyl)piperidin-4-yl]methanone
CID 43920568
1-[(5-bromo-2-methoxyphenyl)methyl]-4-(naphthalen-1-ylmethyl)piperazine
CID 4085464
2-[[4-(2-methoxyphenyl)piperidin-1-yl]methyl]-1-methylbenzimidazol-4-amine
CID 69163958
1-hydroxy-4-(2-methoxyphenyl)piperidine
CID 154170969
3-methyl-1-(naphthalen-1-ylmethyl)pyrrolidine
CID 23396966
4-chloro-1-[(2-methoxyphenyl)methyl]piperidine
CID 63389508
1-[(2-methoxyphenyl)methyl]piperidin-4-amine
CID 70277411
2-[3-(2-methoxyphenyl)pyrrolidin-1-yl]ethanamine
CID 23287971

Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxyphenyl)-1-(naphthalen-1-ylmethyl)piperidine?
The IUPAC name of 4-(2-methoxyphenyl)-1-(naphthalen-1-ylmethyl)piperidine (CID 2802698) is 4-(2-methoxyphenyl)-1-(naphthalen-1-ylmethyl)piperidine.
What is the SMILES notation for 4-(2-methoxyphenyl)-1-(naphthalen-1-ylmethyl)piperidine?
The canonical SMILES for 4-(2-methoxyphenyl)-1-(naphthalen-1-ylmethyl)piperidine is COc1ccccc1C1CCN(Cc2cccc3ccccc23)CC1.
What is the InChIKey of 4-(2-methoxyphenyl)-1-(naphthalen-1-ylmethyl)piperidine?
The InChIKey is SWZOJTTWVCZKTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25NO/c1-25-23-12-5-4-11-22(23)19-13-15-24(16-14-19)17-20-9-6-8-18-7-2-3-10-21(18)20/h2-12,19H,13-17H2,1H3.
What are the key properties of 4-(2-methoxyphenyl)-1-(naphthalen-1-ylmethyl)piperidine?
4-(2-methoxyphenyl)-1-(naphthalen-1-ylmethyl)piperidine has a molecular weight of 331.46 g/mol, XLogP of 5.23, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxyphenyl)-1-(naphthalen-1-ylmethyl)piperidine is sourced from PubChem (CID 2802698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).