morpholin-4-yl-[6-(1-propan-2-ylpiperidin-4-yl)oxy-1H-indol-2-yl]methanone

C21H29N3O3 — CID 11624908

IUPACmorpholin-4-yl-[6-(1-propan-2-ylpiperidin-4-yl)oxy-1H-indol-2-yl]methanone
SMILESCC(C)N1CCC(Oc2ccc3cc(C(=O)N4CCOCC4)[nH]c3c2)CC1
InChIInChI=1S/C21H29N3O3/c1-15(2)23-7-5-17(6-8-23)27-18-4-3-16-13-20(22-19(16)14-18)21(25)24-9-11-26-12-10-24/h3-4,13-15,17,22H,5-12H2,1-2H3
InChIKeyZPDULGLPQKSFGK-UHFFFAOYSA-N
MW371.48 g/mol
LogP2.89
Rot. Bonds4

About morpholin-4-yl-[6-(1-propan-2-ylpiperidin-4-yl)oxy-1H-indol-2-yl]methanone

morpholin-4-yl-[6-(1-propan-2-ylpiperidin-4-yl)oxy-1H-indol-2-yl]methanone (PubChem CID 11624908) has the molecular formula C21H29N3O3 and a molecular weight of 371.48 g/mol. Its IUPAC name is morpholin-4-yl-[6-(1-propan-2-ylpiperidin-4-yl)oxy-1H-indol-2-yl]methanone.

Molecular Properties

Compound Namemorpholin-4-yl-[6-(1-propan-2-ylpiperidin-4-yl)oxy-1H-indol-2-yl]methanone
PubChem CID11624908
Molecular FormulaC21H29N3O3
Molecular Weight371.48 g/mol
Exact Mass371.22
IUPAC Namemorpholin-4-yl-[6-(1-propan-2-ylpiperidin-4-yl)oxy-1H-indol-2-yl]methanone
SMILESCC(C)N1CCC(Oc2ccc3cc(C(=O)N4CCOCC4)[nH]c3c2)CC1
InChIInChI=1S/C21H29N3O3/c1-15(2)23-7-5-17(6-8-23)27-18-4-3-16-13-20(22-19(16)14-18)21(25)24-9-11-26-12-10-24/h3-4,13-15,17,22H,5-12H2,1-2H3
InChIKeyZPDULGLPQKSFGK-UHFFFAOYSA-N
XLogP2.89
TPSA57.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.48
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl-[6-(1-propan-2-ylpiperidin-4-yl)oxy-1H-indol-2-yl]methanone?
The IUPAC name of morpholin-4-yl-[6-(1-propan-2-ylpiperidin-4-yl)oxy-1H-indol-2-yl]methanone (CID 11624908) is morpholin-4-yl-[6-(1-propan-2-ylpiperidin-4-yl)oxy-1H-indol-2-yl]methanone.
What is the SMILES notation for morpholin-4-yl-[6-(1-propan-2-ylpiperidin-4-yl)oxy-1H-indol-2-yl]methanone?
The canonical SMILES for morpholin-4-yl-[6-(1-propan-2-ylpiperidin-4-yl)oxy-1H-indol-2-yl]methanone is CC(C)N1CCC(Oc2ccc3cc(C(=O)N4CCOCC4)[nH]c3c2)CC1.
What is the InChIKey of morpholin-4-yl-[6-(1-propan-2-ylpiperidin-4-yl)oxy-1H-indol-2-yl]methanone?
The InChIKey is ZPDULGLPQKSFGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H29N3O3/c1-15(2)23-7-5-17(6-8-23)27-18-4-3-16-13-20(22-19(16)14-18)21(25)24-9-11-26-12-10-24/h3-4,13-15,17,22H,5-12H2,1-2H3.
What are the key properties of morpholin-4-yl-[6-(1-propan-2-ylpiperidin-4-yl)oxy-1H-indol-2-yl]methanone?
morpholin-4-yl-[6-(1-propan-2-ylpiperidin-4-yl)oxy-1H-indol-2-yl]methanone has a molecular weight of 371.48 g/mol, XLogP of 2.89, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl-[6-(1-propan-2-ylpiperidin-4-yl)oxy-1H-indol-2-yl]methanone is sourced from PubChem (CID 11624908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).