4-(1H-pyrrolo[2,3-b]pyridin-4-yl)-2H-pyrrolo[2,3-b]pyridine

C14H10N4 — CID 67356458

IUPAC4-(1H-pyrrolo[2,3-b]pyridin-4-yl)-2H-pyrrolo[2,3-b]pyridine
SMILESC1=c2c(-c3ccnc4[nH]ccc34)ccnc2=NC1
InChIInChI=1S/C14H10N4/c1-5-15-13-11(3-7-17-13)9(1)10-2-6-16-14-12(10)4-8-18-14/h1-7H,8H2,(H,15,17)
InChIKeyXAQQRDIVJLEKID-UHFFFAOYSA-N
MW234.26 g/mol
LogP1.04
Rot. Bonds1

About 4-(1H-pyrrolo[2,3-b]pyridin-4-yl)-2H-pyrrolo[2,3-b]pyridine

4-(1H-pyrrolo[2,3-b]pyridin-4-yl)-2H-pyrrolo[2,3-b]pyridine (PubChem CID 67356458) has the molecular formula C14H10N4 and a molecular weight of 234.26 g/mol. Its IUPAC name is 4-(1H-pyrrolo[2,3-b]pyridin-4-yl)-2H-pyrrolo[2,3-b]pyridine.

Molecular Properties

Compound Name4-(1H-pyrrolo[2,3-b]pyridin-4-yl)-2H-pyrrolo[2,3-b]pyridine
PubChem CID67356458
Molecular FormulaC14H10N4
Molecular Weight234.26 g/mol
Exact Mass234.09
IUPAC Name4-(1H-pyrrolo[2,3-b]pyridin-4-yl)-2H-pyrrolo[2,3-b]pyridine
SMILESC1=c2c(-c3ccnc4[nH]ccc34)ccnc2=NC1
InChIInChI=1S/C14H10N4/c1-5-15-13-11(3-7-17-13)9(1)10-2-6-16-14-12(10)4-8-18-14/h1-7H,8H2,(H,15,17)
InChIKeyXAQQRDIVJLEKID-UHFFFAOYSA-N
XLogP1.04
TPSA53.93 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.26
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(1,2,3,6-tetrahydropyridin-4-yl)-1H-pyrrolo[2,3-b]pyridine
CID 11999610
4-(4-methylphenyl)-1H-pyrrolo[2,3-b]pyridine
CID 57482994
2-(1H-pyrrolo[2,3-b]pyridin-4-yl)benzonitrile
CID 58896795
4-(4-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridine
CID 66827127
4-(6-fluoro-2-pyridinyl)-1H-pyrrolo[2,3-b]pyridine
CID 11999615
4-(1H-pyrrolo[2,3-b]pyridin-4-yl)benzoic acid
CID 69192349
4-(1H-pyrrolo[2,3-b]pyridin-4-yl)-7H-[1,3]thiazolo[5,4-c]azepine
CID 90828077
4-[4-(1H-pyrrolo[2,3-b]pyridin-4-yl)phenyl]-10-azabicyclo[5.2.1]decane
CID 170614297
2-methoxy-N-(2-methoxyethyl)-N-[[4-(1H-pyrrolo[2,3-b]pyridin-4-yl)phenyl]methyl]ethanamine
CID 24857246
1-methyl-4-(1H-pyrrolo[2,3-b]pyridin-4-yl)pyrazole-3-carboxylic acid
CID 122558338
4-(6-fluoro-2,3-dihydro-1H-inden-4-yl)-1H-pyrrolo[2,3-b]pyridine
CID 166375879
N-methyl-N-[2-(1H-pyrrolo[2,3-b]pyridin-4-yl)phenyl]acetamide
CID 59268074

Frequently Asked Questions

What is the IUPAC name of 4-(1H-pyrrolo[2,3-b]pyridin-4-yl)-2H-pyrrolo[2,3-b]pyridine?
The IUPAC name of 4-(1H-pyrrolo[2,3-b]pyridin-4-yl)-2H-pyrrolo[2,3-b]pyridine (CID 67356458) is 4-(1H-pyrrolo[2,3-b]pyridin-4-yl)-2H-pyrrolo[2,3-b]pyridine.
What is the SMILES notation for 4-(1H-pyrrolo[2,3-b]pyridin-4-yl)-2H-pyrrolo[2,3-b]pyridine?
The canonical SMILES for 4-(1H-pyrrolo[2,3-b]pyridin-4-yl)-2H-pyrrolo[2,3-b]pyridine is C1=c2c(-c3ccnc4[nH]ccc34)ccnc2=NC1.
What is the InChIKey of 4-(1H-pyrrolo[2,3-b]pyridin-4-yl)-2H-pyrrolo[2,3-b]pyridine?
The InChIKey is XAQQRDIVJLEKID-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N4/c1-5-15-13-11(3-7-17-13)9(1)10-2-6-16-14-12(10)4-8-18-14/h1-7H,8H2,(H,15,17).
What are the key properties of 4-(1H-pyrrolo[2,3-b]pyridin-4-yl)-2H-pyrrolo[2,3-b]pyridine?
4-(1H-pyrrolo[2,3-b]pyridin-4-yl)-2H-pyrrolo[2,3-b]pyridine has a molecular weight of 234.26 g/mol, XLogP of 1.04, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1H-pyrrolo[2,3-b]pyridin-4-yl)-2H-pyrrolo[2,3-b]pyridine is sourced from PubChem (CID 67356458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).