5-ethyl-2-[[4-(5-methoxy-1H-indol-3-yl)piperidin-1-yl]methyl]-1,3-oxazole

C20H25N3O2 — CID 71925957

IUPAC5-ethyl-2-[[4-(5-methoxy-1H-indol-3-yl)piperidin-1-yl]methyl]-1,3-oxazole
SMILESCCc1cnc(CN2CCC(c3c[nH]c4ccc(OC)cc34)CC2)o1
InChIInChI=1S/C20H25N3O2/c1-3-15-11-22-20(25-15)13-23-8-6-14(7-9-23)18-12-21-19-5-4-16(24-2)10-17(18)19/h4-5,10-12,14,21H,3,6-9,13H2,1-2H3
InChIKeyFDUJBLYENOJEAM-UHFFFAOYSA-N
MW339.44 g/mol
LogP4.11
Rot. Bonds5

About 5-ethyl-2-[[4-(5-methoxy-1H-indol-3-yl)piperidin-1-yl]methyl]-1,3-oxazole

5-ethyl-2-[[4-(5-methoxy-1H-indol-3-yl)piperidin-1-yl]methyl]-1,3-oxazole (PubChem CID 71925957) has the molecular formula C20H25N3O2 and a molecular weight of 339.44 g/mol. Its IUPAC name is 5-ethyl-2-[[4-(5-methoxy-1H-indol-3-yl)piperidin-1-yl]methyl]-1,3-oxazole.

Molecular Properties

Compound Name5-ethyl-2-[[4-(5-methoxy-1H-indol-3-yl)piperidin-1-yl]methyl]-1,3-oxazole
PubChem CID71925957
Molecular FormulaC20H25N3O2
Molecular Weight339.44 g/mol
Exact Mass339.19
IUPAC Name5-ethyl-2-[[4-(5-methoxy-1H-indol-3-yl)piperidin-1-yl]methyl]-1,3-oxazole
SMILESCCc1cnc(CN2CCC(c3c[nH]c4ccc(OC)cc34)CC2)o1
InChIInChI=1S/C20H25N3O2/c1-3-15-11-22-20(25-15)13-23-8-6-14(7-9-23)18-12-21-19-5-4-16(24-2)10-17(18)19/h4-5,10-12,14,21H,3,6-9,13H2,1-2H3
InChIKeyFDUJBLYENOJEAM-UHFFFAOYSA-N
XLogP4.11
TPSA54.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-methoxy-3-[1-(1H-pyrazol-5-ylmethyl)piperidin-4-yl]-1H-indole
CID 122140104
3-(1-cyclohex-2-en-1-ylpiperidin-4-yl)-5-methoxy-1H-indole
CID 56574521
5-methoxy-3-(1-propan-2-ylpiperidin-4-yl)-1H-indole
CID 47538804
1-(azepan-1-yl)-2-[4-(5-methoxy-1H-indol-3-yl)piperidin-1-yl]ethanone
CID 47538961
(4-hydroxycyclohexyl)-[4-(5-methoxy-1H-indol-3-yl)piperidin-1-yl]methanone
CID 126767282
3-[(2S)-azetidin-2-yl]-5-methoxy-1H-indole
CID 171196660
cyclohexyl-[4-(5-methoxy-1H-indol-3-yl)piperidin-1-yl]methanone
CID 113087522
1-[4-(5-methoxy-1H-indol-3-yl)piperidin-1-yl]-2-pyrimidin-5-ylethanone
CID 100729080
3-[1-[3-(5-methoxy-1H-indol-3-yl)propyl]piperidin-4-yl]-1H-indol-5-ol
CID 21469424
7-[1-[3-(5-methoxy-1H-indol-3-yl)propyl]piperidin-4-yl]-5H-[1,3]dioxolo[4,5-f]indole
CID 21469370
(3-ethyl-1-methylpyrazol-4-yl)-[4-(5-methoxy-1H-indol-3-yl)piperidin-1-yl]methanone
CID 126787585
tert-butyl 4-(5-methoxy-1H-indol-3-yl)piperidine-1-carboxylate
CID 45480277

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2-[[4-(5-methoxy-1H-indol-3-yl)piperidin-1-yl]methyl]-1,3-oxazole?
The IUPAC name of 5-ethyl-2-[[4-(5-methoxy-1H-indol-3-yl)piperidin-1-yl]methyl]-1,3-oxazole (CID 71925957) is 5-ethyl-2-[[4-(5-methoxy-1H-indol-3-yl)piperidin-1-yl]methyl]-1,3-oxazole.
What is the SMILES notation for 5-ethyl-2-[[4-(5-methoxy-1H-indol-3-yl)piperidin-1-yl]methyl]-1,3-oxazole?
The canonical SMILES for 5-ethyl-2-[[4-(5-methoxy-1H-indol-3-yl)piperidin-1-yl]methyl]-1,3-oxazole is CCc1cnc(CN2CCC(c3c[nH]c4ccc(OC)cc34)CC2)o1.
What is the InChIKey of 5-ethyl-2-[[4-(5-methoxy-1H-indol-3-yl)piperidin-1-yl]methyl]-1,3-oxazole?
The InChIKey is FDUJBLYENOJEAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O2/c1-3-15-11-22-20(25-15)13-23-8-6-14(7-9-23)18-12-21-19-5-4-16(24-2)10-17(18)19/h4-5,10-12,14,21H,3,6-9,13H2,1-2H3.
What are the key properties of 5-ethyl-2-[[4-(5-methoxy-1H-indol-3-yl)piperidin-1-yl]methyl]-1,3-oxazole?
5-ethyl-2-[[4-(5-methoxy-1H-indol-3-yl)piperidin-1-yl]methyl]-1,3-oxazole has a molecular weight of 339.44 g/mol, XLogP of 4.11, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2-[[4-(5-methoxy-1H-indol-3-yl)piperidin-1-yl]methyl]-1,3-oxazole is sourced from PubChem (CID 71925957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).