2-[1-(2-methoxyethyl)pyrrolo[2,3-b]pyridin-3-yl]-N-propan-2-ylacetamide

C15H21N3O2 — CID 53144495

IUPAC2-[1-(2-methoxyethyl)pyrrolo[2,3-b]pyridin-3-yl]-N-propan-2-ylacetamide
SMILESCOCCn1cc(CC(=O)NC(C)C)c2cccnc21
InChIInChI=1S/C15H21N3O2/c1-11(2)17-14(19)9-12-10-18(7-8-20-3)15-13(12)5-4-6-16-15/h4-6,10-11H,7-9H2,1-3H3,(H,17,19)
InChIKeyFIPCWIWKIQENTM-UHFFFAOYSA-N
MW275.35 g/mol
LogP1.75
Rot. Bonds6

About 2-[1-(2-methoxyethyl)pyrrolo[2,3-b]pyridin-3-yl]-N-propan-2-ylacetamide

2-[1-(2-methoxyethyl)pyrrolo[2,3-b]pyridin-3-yl]-N-propan-2-ylacetamide (PubChem CID 53144495) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is 2-[1-(2-methoxyethyl)pyrrolo[2,3-b]pyridin-3-yl]-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-[1-(2-methoxyethyl)pyrrolo[2,3-b]pyridin-3-yl]-N-propan-2-ylacetamide
PubChem CID53144495
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC Name2-[1-(2-methoxyethyl)pyrrolo[2,3-b]pyridin-3-yl]-N-propan-2-ylacetamide
SMILESCOCCn1cc(CC(=O)NC(C)C)c2cccnc21
InChIInChI=1S/C15H21N3O2/c1-11(2)17-14(19)9-12-10-18(7-8-20-3)15-13(12)5-4-6-16-15/h4-6,10-11H,7-9H2,1-3H3,(H,17,19)
InChIKeyFIPCWIWKIQENTM-UHFFFAOYSA-N
XLogP1.75
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[1-(2-methoxyethyl)pyrrolo[2,3-b]pyridin-3-yl]-N-propan-2-ylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-methoxyethyl)pyrrolo[2,3-b]pyridin-3-yl]-N-propan-2-ylacetamide?
The IUPAC name of 2-[1-(2-methoxyethyl)pyrrolo[2,3-b]pyridin-3-yl]-N-propan-2-ylacetamide (CID 53144495) is 2-[1-(2-methoxyethyl)pyrrolo[2,3-b]pyridin-3-yl]-N-propan-2-ylacetamide.
What is the SMILES notation for 2-[1-(2-methoxyethyl)pyrrolo[2,3-b]pyridin-3-yl]-N-propan-2-ylacetamide?
The canonical SMILES for 2-[1-(2-methoxyethyl)pyrrolo[2,3-b]pyridin-3-yl]-N-propan-2-ylacetamide is COCCn1cc(CC(=O)NC(C)C)c2cccnc21.
What is the InChIKey of 2-[1-(2-methoxyethyl)pyrrolo[2,3-b]pyridin-3-yl]-N-propan-2-ylacetamide?
The InChIKey is FIPCWIWKIQENTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c1-11(2)17-14(19)9-12-10-18(7-8-20-3)15-13(12)5-4-6-16-15/h4-6,10-11H,7-9H2,1-3H3,(H,17,19).
What are the key properties of 2-[1-(2-methoxyethyl)pyrrolo[2,3-b]pyridin-3-yl]-N-propan-2-ylacetamide?
2-[1-(2-methoxyethyl)pyrrolo[2,3-b]pyridin-3-yl]-N-propan-2-ylacetamide has a molecular weight of 275.35 g/mol, XLogP of 1.75, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-methoxyethyl)pyrrolo[2,3-b]pyridin-3-yl]-N-propan-2-ylacetamide is sourced from PubChem (CID 53144495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).