6,7-dihydro-5H-pyrrolo[3,4-b]pyridine-3-carboxamide

C8H9N3O — CID 154406419

IUPAC6,7-dihydro-5H-pyrrolo[3,4-b]pyridine-3-carboxamide
SMILESNC(=O)c1cnc2c(c1)CNC2
InChIInChI=1S/C8H9N3O/c9-8(12)6-1-5-2-10-4-7(5)11-3-6/h1,3,10H,2,4H2,(H2,9,12)
InChIKeyXEPNVGVWYIVZQV-UHFFFAOYSA-N
MW163.18 g/mol
LogP-0.22
Rot. Bonds1

About 6,7-dihydro-5H-pyrrolo[3,4-b]pyridine-3-carboxamide

6,7-dihydro-5H-pyrrolo[3,4-b]pyridine-3-carboxamide (PubChem CID 154406419) has the molecular formula C8H9N3O and a molecular weight of 163.18 g/mol. Its IUPAC name is 6,7-dihydro-5H-pyrrolo[3,4-b]pyridine-3-carboxamide.

Molecular Properties

Compound Name6,7-dihydro-5H-pyrrolo[3,4-b]pyridine-3-carboxamide
PubChem CID154406419
Molecular FormulaC8H9N3O
Molecular Weight163.18 g/mol
Exact Mass163.07
IUPAC Name6,7-dihydro-5H-pyrrolo[3,4-b]pyridine-3-carboxamide
SMILESNC(=O)c1cnc2c(c1)CNC2
InChIInChI=1S/C8H9N3O/c9-8(12)6-1-5-2-10-4-7(5)11-3-6/h1,3,10H,2,4H2,(H2,9,12)
InChIKeyXEPNVGVWYIVZQV-UHFFFAOYSA-N
XLogP-0.22
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 ≤ 5-0.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1,4-dihydropyrido[3,2-d]pyrimidine-7-carboxamide
CID 175026609
6-(2,3-dihydro-1H-isoindol-5-yloxy)pyridine-3-carboxamide
CID 59730173
N-[(5-ethylsulfonyl-2-pyridinyl)methyl]-6,7-dihydro-5H-pyrrolo[3,4-b]pyridine-3-carboxamide;propane
CID 144897901
(Z)-3-methylimino-2-(5,6,7,8-tetrahydro-1,6-naphthyridin-3-yl)prop-1-en-1-amine
CID 178171862
3,4-dihydro-2H-pyrano[2,3-b]pyridine-6-carboxamide
CID 141418263
1-(6,7,8,9-tetrahydro-5H-pyrido[2,3-d]azepin-3-yl)ethanone
CID 105444403
6,7,8,9-tetrahydro-5H-pyrido[2,3-d]azepine-3-carboxylic acid
CID 105445983
1,2,3,4-tetrahydroisoquinoline-7-carboxamide;hydrochloride
CID 121334078
3-ethoxy-6,7-dihydro-5H-pyrrolo[3,4-b]pyridine
CID 71302980
5,6,7,8-tetrahydro-1,6-naphthyridin-3-amine
CID 53249914
6-(1,2,3,4-tetrahydroisoquinolin-6-yloxy)pyridine-3-carboxamide
CID 59730015
1,7-naphthyridine-3,6-dicarboxamide
CID 90953080

Frequently Asked Questions

What is the IUPAC name of 6,7-dihydro-5H-pyrrolo[3,4-b]pyridine-3-carboxamide?
The IUPAC name of 6,7-dihydro-5H-pyrrolo[3,4-b]pyridine-3-carboxamide (CID 154406419) is 6,7-dihydro-5H-pyrrolo[3,4-b]pyridine-3-carboxamide.
What is the SMILES notation for 6,7-dihydro-5H-pyrrolo[3,4-b]pyridine-3-carboxamide?
The canonical SMILES for 6,7-dihydro-5H-pyrrolo[3,4-b]pyridine-3-carboxamide is NC(=O)c1cnc2c(c1)CNC2.
What is the InChIKey of 6,7-dihydro-5H-pyrrolo[3,4-b]pyridine-3-carboxamide?
The InChIKey is XEPNVGVWYIVZQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3O/c9-8(12)6-1-5-2-10-4-7(5)11-3-6/h1,3,10H,2,4H2,(H2,9,12).
What are the key properties of 6,7-dihydro-5H-pyrrolo[3,4-b]pyridine-3-carboxamide?
6,7-dihydro-5H-pyrrolo[3,4-b]pyridine-3-carboxamide has a molecular weight of 163.18 g/mol, XLogP of -0.22, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dihydro-5H-pyrrolo[3,4-b]pyridine-3-carboxamide is sourced from PubChem (CID 154406419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).