2-(1H-pyrrolo[3,2-c]pyridin-4-yl)acetamide

C9H9N3O — CID 89240037

IUPAC2-(1H-pyrrolo[3,2-c]pyridin-4-yl)acetamide
SMILESNC(=O)Cc1nccc2[nH]ccc12
InChIInChI=1S/C9H9N3O/c10-9(13)5-8-6-1-3-11-7(6)2-4-12-8/h1-4,11H,5H2,(H2,10,13)
InChIKeyCBXYBFWODPTMRA-UHFFFAOYSA-N
MW175.19 g/mol
LogP0.59
Rot. Bonds2

About 2-(1H-pyrrolo[3,2-c]pyridin-4-yl)acetamide

2-(1H-pyrrolo[3,2-c]pyridin-4-yl)acetamide (PubChem CID 89240037) has the molecular formula C9H9N3O and a molecular weight of 175.19 g/mol. Its IUPAC name is 2-(1H-pyrrolo[3,2-c]pyridin-4-yl)acetamide.

Molecular Properties

Compound Name2-(1H-pyrrolo[3,2-c]pyridin-4-yl)acetamide
PubChem CID89240037
Molecular FormulaC9H9N3O
Molecular Weight175.19 g/mol
Exact Mass175.07
IUPAC Name2-(1H-pyrrolo[3,2-c]pyridin-4-yl)acetamide
SMILESNC(=O)Cc1nccc2[nH]ccc12
InChIInChI=1S/C9H9N3O/c10-9(13)5-8-6-1-3-11-7(6)2-4-12-8/h1-4,11H,5H2,(H2,10,13)
InChIKeyCBXYBFWODPTMRA-UHFFFAOYSA-N
XLogP0.59
TPSA71.77 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.19
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(1H-pyrrolo[3,2-c]pyridin-4-yl)acetamide?
The IUPAC name of 2-(1H-pyrrolo[3,2-c]pyridin-4-yl)acetamide (CID 89240037) is 2-(1H-pyrrolo[3,2-c]pyridin-4-yl)acetamide.
What is the SMILES notation for 2-(1H-pyrrolo[3,2-c]pyridin-4-yl)acetamide?
The canonical SMILES for 2-(1H-pyrrolo[3,2-c]pyridin-4-yl)acetamide is NC(=O)Cc1nccc2[nH]ccc12.
What is the InChIKey of 2-(1H-pyrrolo[3,2-c]pyridin-4-yl)acetamide?
The InChIKey is CBXYBFWODPTMRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3O/c10-9(13)5-8-6-1-3-11-7(6)2-4-12-8/h1-4,11H,5H2,(H2,10,13).
What are the key properties of 2-(1H-pyrrolo[3,2-c]pyridin-4-yl)acetamide?
2-(1H-pyrrolo[3,2-c]pyridin-4-yl)acetamide has a molecular weight of 175.19 g/mol, XLogP of 0.59, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-pyrrolo[3,2-c]pyridin-4-yl)acetamide is sourced from PubChem (CID 89240037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).