4-methoxy-N-[[4-[3-(naphthalen-2-ylmethoxy)piperidin-4-yl]phenyl]methyl]benzamide

C31H32N2O3 — CID 22127716

IUPAC4-methoxy-N-[[4-[3-(naphthalen-2-ylmethoxy)piperidin-4-yl]phenyl]methyl]benzamide
SMILESCOc1ccc(C(=O)NCc2ccc(C3CCNCC3OCc3ccc4ccccc4c3)cc2)cc1
InChIInChI=1S/C31H32N2O3/c1-35-28-14-12-26(13-15-28)31(34)33-19-22-6-10-25(11-7-22)29-16-17-32-20-30(29)36-21-23-8-9-24-4-2-3-5-27(24)18-23/h2-15,18,29-30,32H,16-17,19-21H2,1H3,(H,33,34)
InChIKeyCPBKAVXCKPIAGQ-UHFFFAOYSA-N
MW480.61 g/mol
LogP5.44
Rot. Bonds8

About 4-methoxy-N-[[4-[3-(naphthalen-2-ylmethoxy)piperidin-4-yl]phenyl]methyl]benzamide

4-methoxy-N-[[4-[3-(naphthalen-2-ylmethoxy)piperidin-4-yl]phenyl]methyl]benzamide (PubChem CID 22127716) has the molecular formula C31H32N2O3 and a molecular weight of 480.61 g/mol. Its IUPAC name is 4-methoxy-N-[[4-[3-(naphthalen-2-ylmethoxy)piperidin-4-yl]phenyl]methyl]benzamide.

Molecular Properties

Compound Name4-methoxy-N-[[4-[3-(naphthalen-2-ylmethoxy)piperidin-4-yl]phenyl]methyl]benzamide
PubChem CID22127716
Molecular FormulaC31H32N2O3
Molecular Weight480.61 g/mol
Exact Mass480.24
IUPAC Name4-methoxy-N-[[4-[3-(naphthalen-2-ylmethoxy)piperidin-4-yl]phenyl]methyl]benzamide
SMILESCOc1ccc(C(=O)NCc2ccc(C3CCNCC3OCc3ccc4ccccc4c3)cc2)cc1
InChIInChI=1S/C31H32N2O3/c1-35-28-14-12-26(13-15-28)31(34)33-19-22-6-10-25(11-7-22)29-16-17-32-20-30(29)36-21-23-8-9-24-4-2-3-5-27(24)18-23/h2-15,18,29-30,32H,16-17,19-21H2,1H3,(H,33,34)
InChIKeyCPBKAVXCKPIAGQ-UHFFFAOYSA-N
XLogP5.44
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500480.61
LogP ≤ 55.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-methoxy-N-[[4-[3-(naphthalen-2-ylmethoxy)piperidin-4-yl]phenyl]methyl]benzamide 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-[3-(naphthalen-2-ylmethoxy)piperidin-4-yl]-N-(3-oxo-3-phenylpropyl)benzamide
CID 22126678
[4-[3-(naphthalen-2-ylmethoxy)piperidin-4-yl]phenyl]methyl 3,5-dimethoxybenzoate;hydrochloride
CID 22128540
methyl 3-[3-(naphthalen-2-ylmethoxy)piperidin-4-yl]benzoate
CID 54453046
2-[4-[3-(naphthalen-2-ylmethoxy)piperidin-4-yl]phenyl]acetic acid
CID 22127042
N-methyl-4-[3-[(3R,4R)-3-(naphthalen-2-ylmethoxy)piperidin-4-yl]phenyl]benzamide;hydrochloride
CID 67542525
3-(naphthalen-2-ylmethoxy)-4-(4-propylphenyl)piperidine
CID 173295938
4-(4-fluorophenyl)-3-[(6-methoxynaphthalen-2-yl)methoxy]piperidine
CID 22126304
2-[4-[3-(naphthalen-2-ylmethoxy)piperidin-4-yl]phenoxy]ethyl 4-hydroxybenzoate
CID 22127458
3-[(4-methoxyphenyl)methoxy]-4-phenylpiperidine
CID 22127654
5-[4-[3-(naphthalen-2-ylmethoxy)piperidin-4-yl]phenyl]pentanoic acid
CID 174421641
N-[(4-methoxyphenyl)methyl]naphthalene-2-carboxamide
CID 883831
4-[4-[3-(4-methylphenoxy)propoxy]phenyl]-3-(naphthalen-2-ylmethoxy)piperidine
CID 140989345

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[[4-[3-(naphthalen-2-ylmethoxy)piperidin-4-yl]phenyl]methyl]benzamide?
The IUPAC name of 4-methoxy-N-[[4-[3-(naphthalen-2-ylmethoxy)piperidin-4-yl]phenyl]methyl]benzamide (CID 22127716) is 4-methoxy-N-[[4-[3-(naphthalen-2-ylmethoxy)piperidin-4-yl]phenyl]methyl]benzamide.
What is the SMILES notation for 4-methoxy-N-[[4-[3-(naphthalen-2-ylmethoxy)piperidin-4-yl]phenyl]methyl]benzamide?
The canonical SMILES for 4-methoxy-N-[[4-[3-(naphthalen-2-ylmethoxy)piperidin-4-yl]phenyl]methyl]benzamide is COc1ccc(C(=O)NCc2ccc(C3CCNCC3OCc3ccc4ccccc4c3)cc2)cc1.
What is the InChIKey of 4-methoxy-N-[[4-[3-(naphthalen-2-ylmethoxy)piperidin-4-yl]phenyl]methyl]benzamide?
The InChIKey is CPBKAVXCKPIAGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H32N2O3/c1-35-28-14-12-26(13-15-28)31(34)33-19-22-6-10-25(11-7-22)29-16-17-32-20-30(29)36-21-23-8-9-24-4-2-3-5-27(24)18-23/h2-15,18,29-30,32H,16-17,19-21H2,1H3,(H,33,34).
What are the key properties of 4-methoxy-N-[[4-[3-(naphthalen-2-ylmethoxy)piperidin-4-yl]phenyl]methyl]benzamide?
4-methoxy-N-[[4-[3-(naphthalen-2-ylmethoxy)piperidin-4-yl]phenyl]methyl]benzamide has a molecular weight of 480.61 g/mol, XLogP of 5.44, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[[4-[3-(naphthalen-2-ylmethoxy)piperidin-4-yl]phenyl]methyl]benzamide is sourced from PubChem (CID 22127716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).