2,3-dihydro-1H-pyrrolo[3,2-b]pyridine-2-carboxamide

C8H9N3O — CID 140922627

IUPAC2,3-dihydro-1H-pyrrolo[3,2-b]pyridine-2-carboxamide
SMILESNC(=O)C1Cc2ncccc2N1
InChIInChI=1S/C8H9N3O/c9-8(12)7-4-6-5(11-7)2-1-3-10-6/h1-3,7,11H,4H2,(H2,9,12)
InChIKeyBMAGZYFBJPBYLV-UHFFFAOYSA-N
MW163.18 g/mol
LogP-0.10
Rot. Bonds1

About 2,3-dihydro-1H-pyrrolo[3,2-b]pyridine-2-carboxamide

2,3-dihydro-1H-pyrrolo[3,2-b]pyridine-2-carboxamide (PubChem CID 140922627) has the molecular formula C8H9N3O and a molecular weight of 163.18 g/mol. Its IUPAC name is 2,3-dihydro-1H-pyrrolo[3,2-b]pyridine-2-carboxamide.

Molecular Properties

Compound Name2,3-dihydro-1H-pyrrolo[3,2-b]pyridine-2-carboxamide
PubChem CID140922627
Molecular FormulaC8H9N3O
Molecular Weight163.18 g/mol
Exact Mass163.07
IUPAC Name2,3-dihydro-1H-pyrrolo[3,2-b]pyridine-2-carboxamide
SMILESNC(=O)C1Cc2ncccc2N1
InChIInChI=1S/C8H9N3O/c9-8(12)7-4-6-5(11-7)2-1-3-10-6/h1-3,7,11H,4H2,(H2,9,12)
InChIKeyBMAGZYFBJPBYLV-UHFFFAOYSA-N
XLogP-0.10
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.18
LogP ≤ 5-0.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-pyrrolo[3,2-b]pyridine-2-carboxamide?
The IUPAC name of 2,3-dihydro-1H-pyrrolo[3,2-b]pyridine-2-carboxamide (CID 140922627) is 2,3-dihydro-1H-pyrrolo[3,2-b]pyridine-2-carboxamide.
What is the SMILES notation for 2,3-dihydro-1H-pyrrolo[3,2-b]pyridine-2-carboxamide?
The canonical SMILES for 2,3-dihydro-1H-pyrrolo[3,2-b]pyridine-2-carboxamide is NC(=O)C1Cc2ncccc2N1.
What is the InChIKey of 2,3-dihydro-1H-pyrrolo[3,2-b]pyridine-2-carboxamide?
The InChIKey is BMAGZYFBJPBYLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3O/c9-8(12)7-4-6-5(11-7)2-1-3-10-6/h1-3,7,11H,4H2,(H2,9,12).
What are the key properties of 2,3-dihydro-1H-pyrrolo[3,2-b]pyridine-2-carboxamide?
2,3-dihydro-1H-pyrrolo[3,2-b]pyridine-2-carboxamide has a molecular weight of 163.18 g/mol, XLogP of -0.10, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1H-pyrrolo[3,2-b]pyridine-2-carboxamide is sourced from PubChem (CID 140922627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).