3-[1-[(2R)-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]piperidin-4-yl]-1-morpholin-4-ylpropan-1-one

C23H34N2O3 — CID 25382504

IUPAC3-[1-[(2R)-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]piperidin-4-yl]-1-morpholin-4-ylpropan-1-one
SMILESCOc1ccc2c(c1)C[C@H](N1CCC(CCC(=O)N3CCOCC3)CC1)CC2
InChIInChI=1S/C23H34N2O3/c1-27-22-6-4-19-3-5-21(16-20(19)17-22)24-10-8-18(9-11-24)2-7-23(26)25-12-14-28-15-13-25/h4,6,17-18,21H,2-3,5,7-16H2,1H3/t21-/m1/s1
InChIKeyVCJSVIYLGWCIBO-OAQYLSRUSA-N
MW386.54 g/mol
LogP2.90
Rot. Bonds5

About 3-[1-[(2R)-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]piperidin-4-yl]-1-morpholin-4-ylpropan-1-one

3-[1-[(2R)-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]piperidin-4-yl]-1-morpholin-4-ylpropan-1-one (PubChem CID 25382504) has the molecular formula C23H34N2O3 and a molecular weight of 386.54 g/mol. Its IUPAC name is 3-[1-[(2R)-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]piperidin-4-yl]-1-morpholin-4-ylpropan-1-one.

Molecular Properties

Compound Name3-[1-[(2R)-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]piperidin-4-yl]-1-morpholin-4-ylpropan-1-one
PubChem CID25382504
Molecular FormulaC23H34N2O3
Molecular Weight386.54 g/mol
Exact Mass386.26
IUPAC Name3-[1-[(2R)-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]piperidin-4-yl]-1-morpholin-4-ylpropan-1-one
SMILESCOc1ccc2c(c1)C[C@H](N1CCC(CCC(=O)N3CCOCC3)CC1)CC2
InChIInChI=1S/C23H34N2O3/c1-27-22-6-4-19-3-5-21(16-20(19)17-22)24-10-8-18(9-11-24)2-7-23(26)25-12-14-28-15-13-25/h4,6,17-18,21H,2-3,5,7-16H2,1H3/t21-/m1/s1
InChIKeyVCJSVIYLGWCIBO-OAQYLSRUSA-N
XLogP2.90
TPSA42.01 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.54
LogP ≤ 52.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 3-[1-[(2R)-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]piperidin-4-yl]-1-morpholin-4-ylpropan-1-one with MolForge

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Related Compounds

2-[(7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)amino]-1-morpholin-4-ylethanone
CID 84596415
N-(2,4-dimethoxyphenyl)-3-[1-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]piperidin-4-yl]propanamide
CID 26395249
3-amino-1-(7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)pyrrolidine-3-carboxylic acid
CID 107320785
3-[(3S)-1-(2,5-dimethoxybenzoyl)piperidin-3-yl]-1-morpholin-4-ylpropan-1-one
CID 25453434
3-[1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-yl]propanoic acid
CID 65059978
1-morpholin-4-yl-3-[1-[(3S)-thiolan-3-yl]piperidin-4-yl]propan-1-one
CID 42195756
methyl 5-[4-(3-morpholin-4-yl-3-oxopropyl)piperidin-1-yl]-5-oxopentanoate
CID 25450495
(2S)-7-methoxy-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid
CID 10632089
3-[1-[2-(4-methoxyphenoxy)acetyl]piperidin-4-yl]-1-pyrrolidin-1-ylpropan-1-one
CID 42160228
1-(7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)-3-methylpiperazine
CID 115510854
2-[1-[1-(7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-yl]triazol-4-yl]propan-2-amine;bis(2,2,2-trifluoroacetic acid)
CID 154887908
3-[1-(3-methylsulfanylpropanoyl)piperidin-4-yl]-1-morpholin-4-ylpropan-1-one
CID 42556966

Frequently Asked Questions

What is the IUPAC name of 3-[1-[(2R)-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]piperidin-4-yl]-1-morpholin-4-ylpropan-1-one?
The IUPAC name of 3-[1-[(2R)-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]piperidin-4-yl]-1-morpholin-4-ylpropan-1-one (CID 25382504) is 3-[1-[(2R)-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]piperidin-4-yl]-1-morpholin-4-ylpropan-1-one.
What is the SMILES notation for 3-[1-[(2R)-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]piperidin-4-yl]-1-morpholin-4-ylpropan-1-one?
The canonical SMILES for 3-[1-[(2R)-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]piperidin-4-yl]-1-morpholin-4-ylpropan-1-one is COc1ccc2c(c1)C[C@H](N1CCC(CCC(=O)N3CCOCC3)CC1)CC2.
What is the InChIKey of 3-[1-[(2R)-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]piperidin-4-yl]-1-morpholin-4-ylpropan-1-one?
The InChIKey is VCJSVIYLGWCIBO-OAQYLSRUSA-N. The full InChI is InChI=1S/C23H34N2O3/c1-27-22-6-4-19-3-5-21(16-20(19)17-22)24-10-8-18(9-11-24)2-7-23(26)25-12-14-28-15-13-25/h4,6,17-18,21H,2-3,5,7-16H2,1H3/t21-/m1/s1.
What are the key properties of 3-[1-[(2R)-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]piperidin-4-yl]-1-morpholin-4-ylpropan-1-one?
3-[1-[(2R)-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]piperidin-4-yl]-1-morpholin-4-ylpropan-1-one has a molecular weight of 386.54 g/mol, XLogP of 2.90, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-[(2R)-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]piperidin-4-yl]-1-morpholin-4-ylpropan-1-one is sourced from PubChem (CID 25382504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).