2-[6-fluoro-5-(6-methyl-3-pyridinyl)-2-pyridinyl]-1H-pyrrolo[2,3-c]pyridine

C18H13FN4 — CID 146253312

IUPAC2-[6-fluoro-5-(6-methyl-3-pyridinyl)-2-pyridinyl]-1H-pyrrolo[2,3-c]pyridine
SMILESCc1ccc(-c2ccc(-c3cc4ccncc4[nH]3)nc2F)cn1
InChIInChI=1S/C18H13FN4/c1-11-2-3-13(9-21-11)14-4-5-15(23-18(14)19)16-8-12-6-7-20-10-17(12)22-16/h2-10,22H,1H3
InChIKeyMRRBOVRLLPTBRO-UHFFFAOYSA-N
MW304.33 g/mol
LogP4.13
Rot. Bonds2

About 2-[6-fluoro-5-(6-methyl-3-pyridinyl)-2-pyridinyl]-1H-pyrrolo[2,3-c]pyridine

2-[6-fluoro-5-(6-methyl-3-pyridinyl)-2-pyridinyl]-1H-pyrrolo[2,3-c]pyridine (PubChem CID 146253312) has the molecular formula C18H13FN4 and a molecular weight of 304.33 g/mol. Its IUPAC name is 2-[6-fluoro-5-(6-methyl-3-pyridinyl)-2-pyridinyl]-1H-pyrrolo[2,3-c]pyridine.

Molecular Properties

Compound Name2-[6-fluoro-5-(6-methyl-3-pyridinyl)-2-pyridinyl]-1H-pyrrolo[2,3-c]pyridine
PubChem CID146253312
Molecular FormulaC18H13FN4
Molecular Weight304.33 g/mol
Exact Mass304.11
IUPAC Name2-[6-fluoro-5-(6-methyl-3-pyridinyl)-2-pyridinyl]-1H-pyrrolo[2,3-c]pyridine
SMILESCc1ccc(-c2ccc(-c3cc4ccncc4[nH]3)nc2F)cn1
InChIInChI=1S/C18H13FN4/c1-11-2-3-13(9-21-11)14-4-5-15(23-18(14)19)16-8-12-6-7-20-10-17(12)22-16/h2-10,22H,1H3
InChIKeyMRRBOVRLLPTBRO-UHFFFAOYSA-N
XLogP4.13
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.33
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

6-fluoro-N-methyl-5-[4-(1H-pyrrolo[2,3-c]pyridin-2-yl)phenyl]pyridin-2-amine
CID 146253171
4-[2-fluoro-4-(1H-pyrrolo[2,3-c]pyridin-2-yl)phenyl]-N,N-dimethylaniline
CID 146253131
4-(1H-pyrrolo[2,3-c]pyridin-2-yl)-1,3-thiazole
CID 119090254
2-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-c]pyridine
CID 146619016
2-phenyl-1H-pyrrolo[2,3-c]pyridine
CID 11480986
5-pyridin-3-yl-3-(1H-pyrrolo[2,3-c]pyridin-2-yl)-2H-pyrazolo[3,4-b]pyridine
CID 136932197
2-[2,3-difluoro-4-(6-methyl-3-pyridinyl)phenyl]-5-methylpyridine
CID 20663203
2-(2,3-difluoro-4-methylphenyl)-5-(6-methyl-3-pyridinyl)pyridine
CID 22899584
5-(2,4-dichlorophenyl)-2-methylpyridine
CID 57069565
3-(1H-indol-2-yl)-5-(4-methyl-3-pyridinyl)-2H-pyrazolo[3,4-b]pyridine
CID 137280769
tert-butyl 2-[6-fluoro-5-[6-[(2-methylpropan-2-yl)oxycarbonylamino]-3-pyridinyl]-2-pyridinyl]pyrrolo[2,3-c]pyridine-1-carboxylate
CID 160640988
trimethyl(1H-pyrrolo[2,3-c]pyridin-2-yl)silane
CID 15350909

Frequently Asked Questions

What is the IUPAC name of 2-[6-fluoro-5-(6-methyl-3-pyridinyl)-2-pyridinyl]-1H-pyrrolo[2,3-c]pyridine?
The IUPAC name of 2-[6-fluoro-5-(6-methyl-3-pyridinyl)-2-pyridinyl]-1H-pyrrolo[2,3-c]pyridine (CID 146253312) is 2-[6-fluoro-5-(6-methyl-3-pyridinyl)-2-pyridinyl]-1H-pyrrolo[2,3-c]pyridine.
What is the SMILES notation for 2-[6-fluoro-5-(6-methyl-3-pyridinyl)-2-pyridinyl]-1H-pyrrolo[2,3-c]pyridine?
The canonical SMILES for 2-[6-fluoro-5-(6-methyl-3-pyridinyl)-2-pyridinyl]-1H-pyrrolo[2,3-c]pyridine is Cc1ccc(-c2ccc(-c3cc4ccncc4[nH]3)nc2F)cn1.
What is the InChIKey of 2-[6-fluoro-5-(6-methyl-3-pyridinyl)-2-pyridinyl]-1H-pyrrolo[2,3-c]pyridine?
The InChIKey is MRRBOVRLLPTBRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13FN4/c1-11-2-3-13(9-21-11)14-4-5-15(23-18(14)19)16-8-12-6-7-20-10-17(12)22-16/h2-10,22H,1H3.
What are the key properties of 2-[6-fluoro-5-(6-methyl-3-pyridinyl)-2-pyridinyl]-1H-pyrrolo[2,3-c]pyridine?
2-[6-fluoro-5-(6-methyl-3-pyridinyl)-2-pyridinyl]-1H-pyrrolo[2,3-c]pyridine has a molecular weight of 304.33 g/mol, XLogP of 4.13, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-fluoro-5-(6-methyl-3-pyridinyl)-2-pyridinyl]-1H-pyrrolo[2,3-c]pyridine is sourced from PubChem (CID 146253312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).