2-[4-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperidin-1-yl]-N-methylacetamide

C18H26N2O2 — CID 139707137

IUPAC2-[4-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperidin-1-yl]-N-methylacetamide
SMILESCNC(=O)CN1CCC(C2CCc3ccc(OC)cc32)CC1
InChIInChI=1S/C18H26N2O2/c1-19-18(21)12-20-9-7-14(8-10-20)16-6-4-13-3-5-15(22-2)11-17(13)16/h3,5,11,14,16H,4,6-10,12H2,1-2H3,(H,19,21)
InChIKeyVOZXFKHRELPDRL-UHFFFAOYSA-N
MW302.42 g/mol
LogP2.18
Rot. Bonds4

About 2-[4-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperidin-1-yl]-N-methylacetamide

2-[4-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperidin-1-yl]-N-methylacetamide (PubChem CID 139707137) has the molecular formula C18H26N2O2 and a molecular weight of 302.42 g/mol. Its IUPAC name is 2-[4-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperidin-1-yl]-N-methylacetamide.

Molecular Properties

Compound Name2-[4-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperidin-1-yl]-N-methylacetamide
PubChem CID139707137
Molecular FormulaC18H26N2O2
Molecular Weight302.42 g/mol
Exact Mass302.20
IUPAC Name2-[4-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperidin-1-yl]-N-methylacetamide
SMILESCNC(=O)CN1CCC(C2CCc3ccc(OC)cc32)CC1
InChIInChI=1S/C18H26N2O2/c1-19-18(21)12-20-9-7-14(8-10-20)16-6-4-13-3-5-15(22-2)11-17(13)16/h3,5,11,14,16H,4,6-10,12H2,1-2H3,(H,19,21)
InChIKeyVOZXFKHRELPDRL-UHFFFAOYSA-N
XLogP2.18
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.42
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[4-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperidin-1-yl]propan-1-one
CID 21461194
6-methoxy-1,2,3,4,4a,9,10,10a-octahydrophenanthrene
CID 134188965
2,3-dihydroxybutanedioic acid;4-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperidine
CID 21461147
4-[4-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperidin-1-yl]thiadiazole
CID 70279955
3-(6-methoxy-2,3-dihydro-1H-inden-1-yl)-1-methylpiperidine
CID 178102694
3-(6-methoxy-2,3-dihydro-1H-inden-1-yl)pyrrolidine
CID 79368569
2-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]-N-methylacetamide
CID 30986347
2-[4-(6-ethoxy-2,3-dihydro-1H-inden-1-yl)piperazin-1-yl]-N-ethylacetamide
CID 139706624
2-(4-hydroxypiperidin-1-yl)-N-(4-methoxyphenyl)acetamide
CID 51171901
methyl 2-hydroxy-2-(6-methoxy-2,3-dihydro-1H-inden-1-yl)acetate
CID 79367554
2-[4-(6-fluoro-6-methoxy-1,2,3,5-tetrahydroinden-1-yl)piperidin-1-yl]-N-methylacetamide
CID 139707126
1-[1-(6-methoxy-2,3-dihydro-1H-inden-1-yl)pyrrolidin-2-yl]-N-methylmethanamine
CID 115316047

Frequently Asked Questions

What is the IUPAC name of 2-[4-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperidin-1-yl]-N-methylacetamide?
The IUPAC name of 2-[4-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperidin-1-yl]-N-methylacetamide (CID 139707137) is 2-[4-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperidin-1-yl]-N-methylacetamide.
What is the SMILES notation for 2-[4-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperidin-1-yl]-N-methylacetamide?
The canonical SMILES for 2-[4-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperidin-1-yl]-N-methylacetamide is CNC(=O)CN1CCC(C2CCc3ccc(OC)cc32)CC1.
What is the InChIKey of 2-[4-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperidin-1-yl]-N-methylacetamide?
The InChIKey is VOZXFKHRELPDRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O2/c1-19-18(21)12-20-9-7-14(8-10-20)16-6-4-13-3-5-15(22-2)11-17(13)16/h3,5,11,14,16H,4,6-10,12H2,1-2H3,(H,19,21).
What are the key properties of 2-[4-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperidin-1-yl]-N-methylacetamide?
2-[4-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperidin-1-yl]-N-methylacetamide has a molecular weight of 302.42 g/mol, XLogP of 2.18, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperidin-1-yl]-N-methylacetamide is sourced from PubChem (CID 139707137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).