1-(4-chlorophenyl)-2-(3-methyl-4-pyridinyl)pyrrolo[2,3-c]pyridine

C19H14ClN3 — CID 90421678

IUPAC1-(4-chlorophenyl)-2-(3-methyl-4-pyridinyl)pyrrolo[2,3-c]pyridine
SMILESCc1cnccc1-c1cc2ccncc2n1-c1ccc(Cl)cc1
InChIInChI=1S/C19H14ClN3/c1-13-11-21-9-7-17(13)18-10-14-6-8-22-12-19(14)23(18)16-4-2-15(20)3-5-16/h2-12H,1H3
InChIKeyNMORNYBCQXCMMO-UHFFFAOYSA-N
MW319.80 g/mol
LogP5.05
Rot. Bonds2

About 1-(4-chlorophenyl)-2-(3-methyl-4-pyridinyl)pyrrolo[2,3-c]pyridine

1-(4-chlorophenyl)-2-(3-methyl-4-pyridinyl)pyrrolo[2,3-c]pyridine (PubChem CID 90421678) has the molecular formula C19H14ClN3 and a molecular weight of 319.80 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-2-(3-methyl-4-pyridinyl)pyrrolo[2,3-c]pyridine.

Molecular Properties

Compound Name1-(4-chlorophenyl)-2-(3-methyl-4-pyridinyl)pyrrolo[2,3-c]pyridine
PubChem CID90421678
Molecular FormulaC19H14ClN3
Molecular Weight319.80 g/mol
Exact Mass319.09
IUPAC Name1-(4-chlorophenyl)-2-(3-methyl-4-pyridinyl)pyrrolo[2,3-c]pyridine
SMILESCc1cnccc1-c1cc2ccncc2n1-c1ccc(Cl)cc1
InChIInChI=1S/C19H14ClN3/c1-13-11-21-9-7-17(13)18-10-14-6-8-22-12-19(14)23(18)16-4-2-15(20)3-5-16/h2-12H,1H3
InChIKeyNMORNYBCQXCMMO-UHFFFAOYSA-N
XLogP5.05
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500319.80
LogP ≤ 55.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)-2-(3-methyl-4-pyridinyl)pyrrolo[2,3-c]pyridine?
The IUPAC name of 1-(4-chlorophenyl)-2-(3-methyl-4-pyridinyl)pyrrolo[2,3-c]pyridine (CID 90421678) is 1-(4-chlorophenyl)-2-(3-methyl-4-pyridinyl)pyrrolo[2,3-c]pyridine.
What is the SMILES notation for 1-(4-chlorophenyl)-2-(3-methyl-4-pyridinyl)pyrrolo[2,3-c]pyridine?
The canonical SMILES for 1-(4-chlorophenyl)-2-(3-methyl-4-pyridinyl)pyrrolo[2,3-c]pyridine is Cc1cnccc1-c1cc2ccncc2n1-c1ccc(Cl)cc1.
What is the InChIKey of 1-(4-chlorophenyl)-2-(3-methyl-4-pyridinyl)pyrrolo[2,3-c]pyridine?
The InChIKey is NMORNYBCQXCMMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14ClN3/c1-13-11-21-9-7-17(13)18-10-14-6-8-22-12-19(14)23(18)16-4-2-15(20)3-5-16/h2-12H,1H3.
What are the key properties of 1-(4-chlorophenyl)-2-(3-methyl-4-pyridinyl)pyrrolo[2,3-c]pyridine?
1-(4-chlorophenyl)-2-(3-methyl-4-pyridinyl)pyrrolo[2,3-c]pyridine has a molecular weight of 319.80 g/mol, XLogP of 5.05, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)-2-(3-methyl-4-pyridinyl)pyrrolo[2,3-c]pyridine is sourced from PubChem (CID 90421678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).