6-chloro-4H-pyrrolo[1,2-a]indole

C11H8ClN — CID 25228432

IUPAC6-chloro-4H-pyrrolo[1,2-a]indole
SMILESClc1ccc2c(c1)Cc1cccn1-2
InChIInChI=1S/C11H8ClN/c12-9-3-4-11-8(6-9)7-10-2-1-5-13(10)11/h1-6H,7H2
InChIKeyQCZMDGFBNHDSKT-UHFFFAOYSA-N
MW189.65 g/mol
LogP3.03
Rot. Bonds

About 6-chloro-4H-pyrrolo[1,2-a]indole

6-chloro-4H-pyrrolo[1,2-a]indole (PubChem CID 25228432) has the molecular formula C11H8ClN and a molecular weight of 189.65 g/mol. Its IUPAC name is 6-chloro-4H-pyrrolo[1,2-a]indole.

Molecular Properties

Compound Name6-chloro-4H-pyrrolo[1,2-a]indole
PubChem CID25228432
Molecular FormulaC11H8ClN
Molecular Weight189.65 g/mol
Exact Mass189.03
IUPAC Name6-chloro-4H-pyrrolo[1,2-a]indole
SMILESClc1ccc2c(c1)Cc1cccn1-2
InChIInChI=1S/C11H8ClN/c12-9-3-4-11-8(6-9)7-10-2-1-5-13(10)11/h1-6H,7H2
InChIKeyQCZMDGFBNHDSKT-UHFFFAOYSA-N
XLogP3.03
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.65
LogP ≤ 53.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-4H-pyrrolo[1,2-a]indole?
The IUPAC name of 6-chloro-4H-pyrrolo[1,2-a]indole (CID 25228432) is 6-chloro-4H-pyrrolo[1,2-a]indole.
What is the SMILES notation for 6-chloro-4H-pyrrolo[1,2-a]indole?
The canonical SMILES for 6-chloro-4H-pyrrolo[1,2-a]indole is Clc1ccc2c(c1)Cc1cccn1-2.
What is the InChIKey of 6-chloro-4H-pyrrolo[1,2-a]indole?
The InChIKey is QCZMDGFBNHDSKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8ClN/c12-9-3-4-11-8(6-9)7-10-2-1-5-13(10)11/h1-6H,7H2.
What are the key properties of 6-chloro-4H-pyrrolo[1,2-a]indole?
6-chloro-4H-pyrrolo[1,2-a]indole has a molecular weight of 189.65 g/mol, XLogP of 3.03, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-4H-pyrrolo[1,2-a]indole is sourced from PubChem (CID 25228432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).