2-(3-cyano-2-methylindol-1-yl)-N-[2-(4-methylmorpholin-2-yl)ethyl]acetamide

C19H24N4O2 — CID 56707417

IUPAC2-(3-cyano-2-methylindol-1-yl)-N-[2-(4-methylmorpholin-2-yl)ethyl]acetamide
SMILESCc1c(C#N)c2ccccc2n1CC(=O)NCCC1CN(C)CCO1
InChIInChI=1S/C19H24N4O2/c1-14-17(11-20)16-5-3-4-6-18(16)23(14)13-19(24)21-8-7-15-12-22(2)9-10-25-15/h3-6,15H,7-10,12-13H2,1-2H3,(H,21,24)
InChIKeyRSEQQMOHIGTPOS-UHFFFAOYSA-N
MW340.43 g/mol
LogP1.66
Rot. Bonds5

About 2-(3-cyano-2-methylindol-1-yl)-N-[2-(4-methylmorpholin-2-yl)ethyl]acetamide

2-(3-cyano-2-methylindol-1-yl)-N-[2-(4-methylmorpholin-2-yl)ethyl]acetamide (PubChem CID 56707417) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is 2-(3-cyano-2-methylindol-1-yl)-N-[2-(4-methylmorpholin-2-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-(3-cyano-2-methylindol-1-yl)-N-[2-(4-methylmorpholin-2-yl)ethyl]acetamide
PubChem CID56707417
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC Name2-(3-cyano-2-methylindol-1-yl)-N-[2-(4-methylmorpholin-2-yl)ethyl]acetamide
SMILESCc1c(C#N)c2ccccc2n1CC(=O)NCCC1CN(C)CCO1
InChIInChI=1S/C19H24N4O2/c1-14-17(11-20)16-5-3-4-6-18(16)23(14)13-19(24)21-8-7-15-12-22(2)9-10-25-15/h3-6,15H,7-10,12-13H2,1-2H3,(H,21,24)
InChIKeyRSEQQMOHIGTPOS-UHFFFAOYSA-N
XLogP1.66
TPSA70.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(3-cyano-2-methylindol-1-yl)-N-[2-(4-methylmorpholin-2-yl)ethyl]acetamide?
The IUPAC name of 2-(3-cyano-2-methylindol-1-yl)-N-[2-(4-methylmorpholin-2-yl)ethyl]acetamide (CID 56707417) is 2-(3-cyano-2-methylindol-1-yl)-N-[2-(4-methylmorpholin-2-yl)ethyl]acetamide.
What is the SMILES notation for 2-(3-cyano-2-methylindol-1-yl)-N-[2-(4-methylmorpholin-2-yl)ethyl]acetamide?
The canonical SMILES for 2-(3-cyano-2-methylindol-1-yl)-N-[2-(4-methylmorpholin-2-yl)ethyl]acetamide is Cc1c(C#N)c2ccccc2n1CC(=O)NCCC1CN(C)CCO1.
What is the InChIKey of 2-(3-cyano-2-methylindol-1-yl)-N-[2-(4-methylmorpholin-2-yl)ethyl]acetamide?
The InChIKey is RSEQQMOHIGTPOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2/c1-14-17(11-20)16-5-3-4-6-18(16)23(14)13-19(24)21-8-7-15-12-22(2)9-10-25-15/h3-6,15H,7-10,12-13H2,1-2H3,(H,21,24).
What are the key properties of 2-(3-cyano-2-methylindol-1-yl)-N-[2-(4-methylmorpholin-2-yl)ethyl]acetamide?
2-(3-cyano-2-methylindol-1-yl)-N-[2-(4-methylmorpholin-2-yl)ethyl]acetamide has a molecular weight of 340.43 g/mol, XLogP of 1.66, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-cyano-2-methylindol-1-yl)-N-[2-(4-methylmorpholin-2-yl)ethyl]acetamide is sourced from PubChem (CID 56707417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).