1-methyl-N-(2-morpholin-4-ylethyl)indole-6-carboxamide

C16H21N3O2 — CID 112520338

IUPAC1-methyl-N-(2-morpholin-4-ylethyl)indole-6-carboxamide
SMILESCn1ccc2ccc(C(=O)NCCN3CCOCC3)cc21
InChIInChI=1S/C16H21N3O2/c1-18-6-4-13-2-3-14(12-15(13)18)16(20)17-5-7-19-8-10-21-11-9-19/h2-4,6,12H,5,7-11H2,1H3,(H,17,20)
InChIKeyNWJIKMTWDUIUOH-UHFFFAOYSA-N
MW287.36 g/mol
LogP1.24
Rot. Bonds4

About 1-methyl-N-(2-morpholin-4-ylethyl)indole-6-carboxamide

1-methyl-N-(2-morpholin-4-ylethyl)indole-6-carboxamide (PubChem CID 112520338) has the molecular formula C16H21N3O2 and a molecular weight of 287.36 g/mol. Its IUPAC name is 1-methyl-N-(2-morpholin-4-ylethyl)indole-6-carboxamide.

Molecular Properties

Compound Name1-methyl-N-(2-morpholin-4-ylethyl)indole-6-carboxamide
PubChem CID112520338
Molecular FormulaC16H21N3O2
Molecular Weight287.36 g/mol
Exact Mass287.16
IUPAC Name1-methyl-N-(2-morpholin-4-ylethyl)indole-6-carboxamide
SMILESCn1ccc2ccc(C(=O)NCCN3CCOCC3)cc21
InChIInChI=1S/C16H21N3O2/c1-18-6-4-13-2-3-14(12-15(13)18)16(20)17-5-7-19-8-10-21-11-9-19/h2-4,6,12H,5,7-11H2,1H3,(H,17,20)
InChIKeyNWJIKMTWDUIUOH-UHFFFAOYSA-N
XLogP1.24
TPSA46.50 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-methyl-N-(2-morpholin-4-ylethyl)naphthalene-2-carboxamide
CID 142825868
4-methyl-N-(2-morpholin-4-ylethyl)benzamide
CID 803484
3-iodo-4-methyl-N-(2-morpholin-4-ylethyl)benzamide
CID 134052243
1,2-dimethyl-N-(2-morpholin-4-ylethyl)pyrrole-3-carboxamide
CID 91130996
6-methyl-N-(3-morpholin-4-ylpropyl)naphthalene-2-carboxamide
CID 142825714
6-(2-morpholin-4-ylethylcarbamoyl)-1H-indole-2-carboxylic acid
CID 19608777
4-N-tert-butyl-1-N-(2-morpholin-4-ylethyl)benzene-1,4-dicarboxamide
CID 109045886
3-bromo-4-fluoro-N-(2-morpholin-4-ylethyl)benzamide
CID 103706316
N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1-methylindole-6-carboxamide
CID 112529886
2-amino-N-(2-morpholin-4-ylethyl)quinazoline-7-carboxamide
CID 143569714
3-chloro-N-(2-morpholin-4-ylethyl)benzamide
CID 669179
3-bromo-N-(2-morpholin-4-ylethyl)benzamide
CID 669309

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(2-morpholin-4-ylethyl)indole-6-carboxamide?
The IUPAC name of 1-methyl-N-(2-morpholin-4-ylethyl)indole-6-carboxamide (CID 112520338) is 1-methyl-N-(2-morpholin-4-ylethyl)indole-6-carboxamide.
What is the SMILES notation for 1-methyl-N-(2-morpholin-4-ylethyl)indole-6-carboxamide?
The canonical SMILES for 1-methyl-N-(2-morpholin-4-ylethyl)indole-6-carboxamide is Cn1ccc2ccc(C(=O)NCCN3CCOCC3)cc21.
What is the InChIKey of 1-methyl-N-(2-morpholin-4-ylethyl)indole-6-carboxamide?
The InChIKey is NWJIKMTWDUIUOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O2/c1-18-6-4-13-2-3-14(12-15(13)18)16(20)17-5-7-19-8-10-21-11-9-19/h2-4,6,12H,5,7-11H2,1H3,(H,17,20).
What are the key properties of 1-methyl-N-(2-morpholin-4-ylethyl)indole-6-carboxamide?
1-methyl-N-(2-morpholin-4-ylethyl)indole-6-carboxamide has a molecular weight of 287.36 g/mol, XLogP of 1.24, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(2-morpholin-4-ylethyl)indole-6-carboxamide is sourced from PubChem (CID 112520338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).