(2-ethoxy-6-methyl-3-pyridinyl)-[4-(1H-indol-3-yl)piperidin-1-yl]methanone

C22H25N3O2 — CID 119047088

IUPAC(2-ethoxy-6-methyl-3-pyridinyl)-[4-(1H-indol-3-yl)piperidin-1-yl]methanone
SMILESCCOc1nc(C)ccc1C(=O)N1CCC(c2c[nH]c3ccccc23)CC1
InChIInChI=1S/C22H25N3O2/c1-3-27-21-18(9-8-15(2)24-21)22(26)25-12-10-16(11-13-25)19-14-23-20-7-5-4-6-17(19)20/h4-9,14,16,23H,3,10-13H2,1-2H3
InChIKeyFDDABYGTMNDHGP-UHFFFAOYSA-N
MW363.46 g/mol
LogP4.29
Rot. Bonds4

About (2-ethoxy-6-methyl-3-pyridinyl)-[4-(1H-indol-3-yl)piperidin-1-yl]methanone

(2-ethoxy-6-methyl-3-pyridinyl)-[4-(1H-indol-3-yl)piperidin-1-yl]methanone (PubChem CID 119047088) has the molecular formula C22H25N3O2 and a molecular weight of 363.46 g/mol. Its IUPAC name is (2-ethoxy-6-methyl-3-pyridinyl)-[4-(1H-indol-3-yl)piperidin-1-yl]methanone.

Molecular Properties

Compound Name(2-ethoxy-6-methyl-3-pyridinyl)-[4-(1H-indol-3-yl)piperidin-1-yl]methanone
PubChem CID119047088
Molecular FormulaC22H25N3O2
Molecular Weight363.46 g/mol
Exact Mass363.19
IUPAC Name(2-ethoxy-6-methyl-3-pyridinyl)-[4-(1H-indol-3-yl)piperidin-1-yl]methanone
SMILESCCOc1nc(C)ccc1C(=O)N1CCC(c2c[nH]c3ccccc23)CC1
InChIInChI=1S/C22H25N3O2/c1-3-27-21-18(9-8-15(2)24-21)22(26)25-12-10-16(11-13-25)19-14-23-20-7-5-4-6-17(19)20/h4-9,14,16,23H,3,10-13H2,1-2H3
InChIKeyFDDABYGTMNDHGP-UHFFFAOYSA-N
XLogP4.29
TPSA58.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.46
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (2-ethoxy-6-methyl-3-pyridinyl)-[4-(1H-indol-3-yl)piperidin-1-yl]methanone with MolForge

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Related Compounds

[4-(1H-indol-3-yl)piperidin-1-yl]-(2-methylphenyl)methanone
CID 84559294
[4-(1H-indol-3-yl)piperidin-1-yl]-(2-phenoxy-3-pyridinyl)methanone
CID 24646101
[4-(1H-indol-3-yl)piperidin-1-yl]-(2-methoxyphenyl)methanone
CID 84559095
ethyl 3-(1H-indol-3-yl)pyrrolidine-1-carboxylate
CID 110711039
[4-(1H-indol-3-yl)piperidin-1-yl]-pyridin-2-ylmethanone
CID 122190657
[3-(1H-indol-3-yl)pyrrolidin-1-yl]-(2-methylphenyl)methanone
CID 70686769
[3-(1H-indol-3-yl)pyrrolidin-1-yl]-(2-methoxyphenyl)methanone
CID 110711026
(4-bromophenyl)-[4-(1H-indol-3-yl)piperidin-1-yl]methanone
CID 84558962
[4-(1H-indol-3-yl)piperidin-1-yl]-(2-methylpyrazolo[1,5-a]pyrimidin-3-yl)methanone
CID 86839792
(2-ethoxy-6-methyl-3-pyridinyl)-[3-hydroxy-4-[[2-(methylaminomethyl)phenyl]methyl]piperidin-1-yl]methanone
CID 156793422
[3-chloro-6-(3,5-dimethylpyrazol-1-yl)-2-pyridinyl]-[4-(1H-indol-3-yl)piperidin-1-yl]methanone
CID 78836013
(3,4-dichlorophenyl)-[4-(1H-indol-3-yl)piperidin-1-yl]methanone
CID 84558891

Frequently Asked Questions

What is the IUPAC name of (2-ethoxy-6-methyl-3-pyridinyl)-[4-(1H-indol-3-yl)piperidin-1-yl]methanone?
The IUPAC name of (2-ethoxy-6-methyl-3-pyridinyl)-[4-(1H-indol-3-yl)piperidin-1-yl]methanone (CID 119047088) is (2-ethoxy-6-methyl-3-pyridinyl)-[4-(1H-indol-3-yl)piperidin-1-yl]methanone.
What is the SMILES notation for (2-ethoxy-6-methyl-3-pyridinyl)-[4-(1H-indol-3-yl)piperidin-1-yl]methanone?
The canonical SMILES for (2-ethoxy-6-methyl-3-pyridinyl)-[4-(1H-indol-3-yl)piperidin-1-yl]methanone is CCOc1nc(C)ccc1C(=O)N1CCC(c2c[nH]c3ccccc23)CC1.
What is the InChIKey of (2-ethoxy-6-methyl-3-pyridinyl)-[4-(1H-indol-3-yl)piperidin-1-yl]methanone?
The InChIKey is FDDABYGTMNDHGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N3O2/c1-3-27-21-18(9-8-15(2)24-21)22(26)25-12-10-16(11-13-25)19-14-23-20-7-5-4-6-17(19)20/h4-9,14,16,23H,3,10-13H2,1-2H3.
What are the key properties of (2-ethoxy-6-methyl-3-pyridinyl)-[4-(1H-indol-3-yl)piperidin-1-yl]methanone?
(2-ethoxy-6-methyl-3-pyridinyl)-[4-(1H-indol-3-yl)piperidin-1-yl]methanone has a molecular weight of 363.46 g/mol, XLogP of 4.29, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethoxy-6-methyl-3-pyridinyl)-[4-(1H-indol-3-yl)piperidin-1-yl]methanone is sourced from PubChem (CID 119047088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).