morpholin-4-yl-[5-[(1-propan-2-ylpiperidin-4-yl)amino]-1H-indol-2-yl]methanone

C21H30N4O2 — CID 11530812

IUPACmorpholin-4-yl-[5-[(1-propan-2-ylpiperidin-4-yl)amino]-1H-indol-2-yl]methanone
SMILESCC(C)N1CCC(Nc2ccc3[nH]c(C(=O)N4CCOCC4)cc3c2)CC1
InChIInChI=1S/C21H30N4O2/c1-15(2)24-7-5-17(6-8-24)22-18-3-4-19-16(13-18)14-20(23-19)21(26)25-9-11-27-12-10-25/h3-4,13-15,17,22-23H,5-12H2,1-2H3
InChIKeySCFIWGDFNXLWQX-UHFFFAOYSA-N
MW370.50 g/mol
LogP2.92
Rot. Bonds4

About morpholin-4-yl-[5-[(1-propan-2-ylpiperidin-4-yl)amino]-1H-indol-2-yl]methanone

morpholin-4-yl-[5-[(1-propan-2-ylpiperidin-4-yl)amino]-1H-indol-2-yl]methanone (PubChem CID 11530812) has the molecular formula C21H30N4O2 and a molecular weight of 370.50 g/mol. Its IUPAC name is morpholin-4-yl-[5-[(1-propan-2-ylpiperidin-4-yl)amino]-1H-indol-2-yl]methanone.

Molecular Properties

Compound Namemorpholin-4-yl-[5-[(1-propan-2-ylpiperidin-4-yl)amino]-1H-indol-2-yl]methanone
PubChem CID11530812
Molecular FormulaC21H30N4O2
Molecular Weight370.50 g/mol
Exact Mass370.24
IUPAC Namemorpholin-4-yl-[5-[(1-propan-2-ylpiperidin-4-yl)amino]-1H-indol-2-yl]methanone
SMILESCC(C)N1CCC(Nc2ccc3[nH]c(C(=O)N4CCOCC4)cc3c2)CC1
InChIInChI=1S/C21H30N4O2/c1-15(2)24-7-5-17(6-8-24)22-18-3-4-19-16(13-18)14-20(23-19)21(26)25-9-11-27-12-10-25/h3-4,13-15,17,22-23H,5-12H2,1-2H3
InChIKeySCFIWGDFNXLWQX-UHFFFAOYSA-N
XLogP2.92
TPSA60.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.50
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl-[5-[(1-propan-2-ylpiperidin-4-yl)amino]-1H-indol-2-yl]methanone?
The IUPAC name of morpholin-4-yl-[5-[(1-propan-2-ylpiperidin-4-yl)amino]-1H-indol-2-yl]methanone (CID 11530812) is morpholin-4-yl-[5-[(1-propan-2-ylpiperidin-4-yl)amino]-1H-indol-2-yl]methanone.
What is the SMILES notation for morpholin-4-yl-[5-[(1-propan-2-ylpiperidin-4-yl)amino]-1H-indol-2-yl]methanone?
The canonical SMILES for morpholin-4-yl-[5-[(1-propan-2-ylpiperidin-4-yl)amino]-1H-indol-2-yl]methanone is CC(C)N1CCC(Nc2ccc3[nH]c(C(=O)N4CCOCC4)cc3c2)CC1.
What is the InChIKey of morpholin-4-yl-[5-[(1-propan-2-ylpiperidin-4-yl)amino]-1H-indol-2-yl]methanone?
The InChIKey is SCFIWGDFNXLWQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H30N4O2/c1-15(2)24-7-5-17(6-8-24)22-18-3-4-19-16(13-18)14-20(23-19)21(26)25-9-11-27-12-10-25/h3-4,13-15,17,22-23H,5-12H2,1-2H3.
What are the key properties of morpholin-4-yl-[5-[(1-propan-2-ylpiperidin-4-yl)amino]-1H-indol-2-yl]methanone?
morpholin-4-yl-[5-[(1-propan-2-ylpiperidin-4-yl)amino]-1H-indol-2-yl]methanone has a molecular weight of 370.50 g/mol, XLogP of 2.92, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl-[5-[(1-propan-2-ylpiperidin-4-yl)amino]-1H-indol-2-yl]methanone is sourced from PubChem (CID 11530812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).