pyridine;1H-pyrrolo[2,3-b]pyridine

C12H11N3 — CID 137361051

IUPACpyridine;1H-pyrrolo[2,3-b]pyridine
SMILESc1ccncc1.c1cnc2[nH]ccc2c1
InChIInChI=1S/C7H6N2.C5H5N/c1-2-6-3-5-9-7(6)8-4-1;1-2-4-6-5-3-1/h1-5H,(H,8,9);1-5H
InChIKeyLRRYUFALUBPDBU-UHFFFAOYSA-N
MW197.24 g/mol
LogP2.64
Rot. Bonds

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

pyridine;1H-pyrrolo[2,3-b]pyridine (PubChem CID 137361051) has the molecular formula C12H11N3 and a molecular weight of 197.24 g/mol. Its IUPAC name is pyridine;1H-pyrrolo[2,3-b]pyridine.

Molecular Properties

Compound Namepyridine;1H-pyrrolo[2,3-b]pyridine
PubChem CID137361051
Molecular FormulaC12H11N3
Molecular Weight197.24 g/mol
Exact Mass197.10
IUPAC Namepyridine;1H-pyrrolo[2,3-b]pyridine
SMILESc1ccncc1.c1cnc2[nH]ccc2c1
InChIInChI=1S/C7H6N2.C5H5N/c1-2-6-3-5-9-7(6)8-4-1;1-2-4-6-5-3-1/h1-5H,(H,8,9);1-5H
InChIKeyLRRYUFALUBPDBU-UHFFFAOYSA-N
XLogP2.64
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

methanethiol;1H-pyrrolo[2,3-b]pyridine
CID 145094604
bromo(trifluoro)methane;1H-pyrrolo[2,3-b]pyridine
CID 174310958
pyrimidin-2-amine;1H-pyrrolo[2,3-b]pyridine
CID 67326610
molecular hydrogen;propane;1H-pyrrolo[2,3-b]pyridine
CID 163390123
1H-indole;pyridine;quinoline
CID 158744845
4-methylsulfanylaniline;1H-pyrrolo[2,3-b]pyridine
CID 145235638
pyridine;1H-pyrrolo[3,2-c]pyridine
CID 160880011
6-methylpurin-6-amine;1H-pyrrolo[2,3-b]pyridine
CID 161406896
5-fluoro-1H-indole;pyridine;quinoline
CID 174896082
1,5-naphthyridine;pyridine
CID 158398713
9H-carbazole;1H-indole;pyridine
CID 161417632
benzene;methane;naphthalene;pyridine;quinoline
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Frequently Asked Questions

What is the IUPAC name of pyridine;1H-pyrrolo[2,3-b]pyridine?
The IUPAC name of pyridine;1H-pyrrolo[2,3-b]pyridine (CID 137361051) is pyridine;1H-pyrrolo[2,3-b]pyridine.
What is the SMILES notation for pyridine;1H-pyrrolo[2,3-b]pyridine?
The canonical SMILES for pyridine;1H-pyrrolo[2,3-b]pyridine is c1ccncc1.c1cnc2[nH]ccc2c1.
What is the InChIKey of pyridine;1H-pyrrolo[2,3-b]pyridine?
The InChIKey is LRRYUFALUBPDBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6N2.C5H5N/c1-2-6-3-5-9-7(6)8-4-1;1-2-4-6-5-3-1/h1-5H,(H,8,9);1-5H.
What are the key properties of pyridine;1H-pyrrolo[2,3-b]pyridine?
pyridine;1H-pyrrolo[2,3-b]pyridine has a molecular weight of 197.24 g/mol, XLogP of 2.64, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for pyridine;1H-pyrrolo[2,3-b]pyridine is sourced from PubChem (CID 137361051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).