1-(4-chloro-3-methylphenyl)pyrrolo[2,3-c]pyridine

C14H11ClN2 — CID 57327816

IUPAC1-(4-chloro-3-methylphenyl)pyrrolo[2,3-c]pyridine
SMILESCc1cc(-n2ccc3ccncc32)ccc1Cl
InChIInChI=1S/C14H11ClN2/c1-10-8-12(2-3-13(10)15)17-7-5-11-4-6-16-9-14(11)17/h2-9H,1H3
InChIKeyOBZDWSGYKGSBFR-UHFFFAOYSA-N
MW242.71 g/mol
LogP3.99
Rot. Bonds1

About 1-(4-chloro-3-methylphenyl)pyrrolo[2,3-c]pyridine

1-(4-chloro-3-methylphenyl)pyrrolo[2,3-c]pyridine (PubChem CID 57327816) has the molecular formula C14H11ClN2 and a molecular weight of 242.71 g/mol. Its IUPAC name is 1-(4-chloro-3-methylphenyl)pyrrolo[2,3-c]pyridine.

Molecular Properties

Compound Name1-(4-chloro-3-methylphenyl)pyrrolo[2,3-c]pyridine
PubChem CID57327816
Molecular FormulaC14H11ClN2
Molecular Weight242.71 g/mol
Exact Mass242.06
IUPAC Name1-(4-chloro-3-methylphenyl)pyrrolo[2,3-c]pyridine
SMILESCc1cc(-n2ccc3ccncc32)ccc1Cl
InChIInChI=1S/C14H11ClN2/c1-10-8-12(2-3-13(10)15)17-7-5-11-4-6-16-9-14(11)17/h2-9H,1H3
InChIKeyOBZDWSGYKGSBFR-UHFFFAOYSA-N
XLogP3.99
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.71
LogP ≤ 53.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(4-chloro-3-methylphenyl)pyrrolo[2,3-c]pyridine?
The IUPAC name of 1-(4-chloro-3-methylphenyl)pyrrolo[2,3-c]pyridine (CID 57327816) is 1-(4-chloro-3-methylphenyl)pyrrolo[2,3-c]pyridine.
What is the SMILES notation for 1-(4-chloro-3-methylphenyl)pyrrolo[2,3-c]pyridine?
The canonical SMILES for 1-(4-chloro-3-methylphenyl)pyrrolo[2,3-c]pyridine is Cc1cc(-n2ccc3ccncc32)ccc1Cl.
What is the InChIKey of 1-(4-chloro-3-methylphenyl)pyrrolo[2,3-c]pyridine?
The InChIKey is OBZDWSGYKGSBFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClN2/c1-10-8-12(2-3-13(10)15)17-7-5-11-4-6-16-9-14(11)17/h2-9H,1H3.
What are the key properties of 1-(4-chloro-3-methylphenyl)pyrrolo[2,3-c]pyridine?
1-(4-chloro-3-methylphenyl)pyrrolo[2,3-c]pyridine has a molecular weight of 242.71 g/mol, XLogP of 3.99, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chloro-3-methylphenyl)pyrrolo[2,3-c]pyridine is sourced from PubChem (CID 57327816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).