3-methyl-N-(4-methyl-2-morpholin-4-ylpentyl)-2,3-dihydroindole-1-carboxamide

C20H31N3O2 — CID 87003405

IUPAC3-methyl-N-(4-methyl-2-morpholin-4-ylpentyl)-2,3-dihydroindole-1-carboxamide
SMILESCC(C)CC(CNC(=O)N1CC(C)c2ccccc21)N1CCOCC1
InChIInChI=1S/C20H31N3O2/c1-15(2)12-17(22-8-10-25-11-9-22)13-21-20(24)23-14-16(3)18-6-4-5-7-19(18)23/h4-7,15-17H,8-14H2,1-3H3,(H,21,24)
InChIKeyIXRZGEFDFOLAPG-UHFFFAOYSA-N
MW345.49 g/mol
LogP3.07
Rot. Bonds5

About 3-methyl-N-(4-methyl-2-morpholin-4-ylpentyl)-2,3-dihydroindole-1-carboxamide

3-methyl-N-(4-methyl-2-morpholin-4-ylpentyl)-2,3-dihydroindole-1-carboxamide (PubChem CID 87003405) has the molecular formula C20H31N3O2 and a molecular weight of 345.49 g/mol. Its IUPAC name is 3-methyl-N-(4-methyl-2-morpholin-4-ylpentyl)-2,3-dihydroindole-1-carboxamide.

Molecular Properties

Compound Name3-methyl-N-(4-methyl-2-morpholin-4-ylpentyl)-2,3-dihydroindole-1-carboxamide
PubChem CID87003405
Molecular FormulaC20H31N3O2
Molecular Weight345.49 g/mol
Exact Mass345.24
IUPAC Name3-methyl-N-(4-methyl-2-morpholin-4-ylpentyl)-2,3-dihydroindole-1-carboxamide
SMILESCC(C)CC(CNC(=O)N1CC(C)c2ccccc21)N1CCOCC1
InChIInChI=1S/C20H31N3O2/c1-15(2)12-17(22-8-10-25-11-9-22)13-21-20(24)23-14-16(3)18-6-4-5-7-19(18)23/h4-7,15-17H,8-14H2,1-3H3,(H,21,24)
InChIKeyIXRZGEFDFOLAPG-UHFFFAOYSA-N
XLogP3.07
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.49
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3S)-3-methyl-N-[(2S)-2-methyl-3-(2-methyl-1,3-dioxolan-2-yl)propyl]-2,3-dihydroindole-1-carboxamide
CID 97094670
N-(4-methyl-2-morpholin-4-ylpentyl)morpholine-4-carboxamide
CID 110403300
N-(4-methyl-2-morpholin-4-ylpentyl)-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide
CID 134027214
3-methyl-N-(5-methylhexan-2-yl)-2,3-dihydroindole-1-carboxamide
CID 78889309
1-(2-chlorophenyl)-N-(4-methyl-2-morpholin-4-ylpentyl)-5-oxopyrrolidine-3-carboxamide
CID 43050162
N-(4-methyl-2-morpholin-4-ylpentyl)-2-naphthalen-2-ylacetamide
CID 46540850
N-[3-(3,5-dimethylpyrazol-1-yl)-2-methylpropyl]-3-methyl-2,3-dihydroindole-1-carboxamide
CID 87007925
2-methoxy-N-(4-methyl-2-morpholin-4-ylpentyl)benzamide
CID 110403268
N'-methyl-N-(4-methyl-2-morpholin-4-ylpentyl)-2,3-dihydroindole-1-carboximidamide
CID 110985146
3-hydroxy-N-(4-methyl-2-morpholin-4-ylpentyl)naphthalene-2-carboxamide
CID 46540851
2-(cyclopropylamino)-N-(4-methyl-2-morpholin-4-ylpentyl)acetamide
CID 61249539
2-ethoxy-N-(4-methyl-2-morpholin-4-ylpentyl)benzamide
CID 134027029

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(4-methyl-2-morpholin-4-ylpentyl)-2,3-dihydroindole-1-carboxamide?
The IUPAC name of 3-methyl-N-(4-methyl-2-morpholin-4-ylpentyl)-2,3-dihydroindole-1-carboxamide (CID 87003405) is 3-methyl-N-(4-methyl-2-morpholin-4-ylpentyl)-2,3-dihydroindole-1-carboxamide.
What is the SMILES notation for 3-methyl-N-(4-methyl-2-morpholin-4-ylpentyl)-2,3-dihydroindole-1-carboxamide?
The canonical SMILES for 3-methyl-N-(4-methyl-2-morpholin-4-ylpentyl)-2,3-dihydroindole-1-carboxamide is CC(C)CC(CNC(=O)N1CC(C)c2ccccc21)N1CCOCC1.
What is the InChIKey of 3-methyl-N-(4-methyl-2-morpholin-4-ylpentyl)-2,3-dihydroindole-1-carboxamide?
The InChIKey is IXRZGEFDFOLAPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H31N3O2/c1-15(2)12-17(22-8-10-25-11-9-22)13-21-20(24)23-14-16(3)18-6-4-5-7-19(18)23/h4-7,15-17H,8-14H2,1-3H3,(H,21,24).
What are the key properties of 3-methyl-N-(4-methyl-2-morpholin-4-ylpentyl)-2,3-dihydroindole-1-carboxamide?
3-methyl-N-(4-methyl-2-morpholin-4-ylpentyl)-2,3-dihydroindole-1-carboxamide has a molecular weight of 345.49 g/mol, XLogP of 3.07, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(4-methyl-2-morpholin-4-ylpentyl)-2,3-dihydroindole-1-carboxamide is sourced from PubChem (CID 87003405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).