2-chloro-1H-pyrrolo[2,3-h]quinoline

C11H7ClN2 — CID 152757444

IUPAC2-chloro-1H-pyrrolo[2,3-h]quinoline
SMILESClc1ccc2ccc3nccc3c2[nH]1
InChIInChI=1S/C11H7ClN2/c12-10-4-2-7-1-3-9-8(5-6-13-9)11(7)14-10/h1-6,14H
InChIKeyWEGRSHZPFNCDCK-UHFFFAOYSA-N
MW202.64 g/mol
LogP3.37
Rot. Bonds

About 2-chloro-1H-pyrrolo[2,3-h]quinoline

2-chloro-1H-pyrrolo[2,3-h]quinoline (PubChem CID 152757444) has the molecular formula C11H7ClN2 and a molecular weight of 202.64 g/mol. Its IUPAC name is 2-chloro-1H-pyrrolo[2,3-h]quinoline.

Molecular Properties

Compound Name2-chloro-1H-pyrrolo[2,3-h]quinoline
PubChem CID152757444
Molecular FormulaC11H7ClN2
Molecular Weight202.64 g/mol
Exact Mass202.03
IUPAC Name2-chloro-1H-pyrrolo[2,3-h]quinoline
SMILESClc1ccc2ccc3nccc3c2[nH]1
InChIInChI=1S/C11H7ClN2/c12-10-4-2-7-1-3-9-8(5-6-13-9)11(7)14-10/h1-6,14H
InChIKeyWEGRSHZPFNCDCK-UHFFFAOYSA-N
XLogP3.37
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.64
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-1H-pyrrolo[2,3-h]quinoline?
The IUPAC name of 2-chloro-1H-pyrrolo[2,3-h]quinoline (CID 152757444) is 2-chloro-1H-pyrrolo[2,3-h]quinoline.
What is the SMILES notation for 2-chloro-1H-pyrrolo[2,3-h]quinoline?
The canonical SMILES for 2-chloro-1H-pyrrolo[2,3-h]quinoline is Clc1ccc2ccc3nccc3c2[nH]1.
What is the InChIKey of 2-chloro-1H-pyrrolo[2,3-h]quinoline?
The InChIKey is WEGRSHZPFNCDCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7ClN2/c12-10-4-2-7-1-3-9-8(5-6-13-9)11(7)14-10/h1-6,14H.
What are the key properties of 2-chloro-1H-pyrrolo[2,3-h]quinoline?
2-chloro-1H-pyrrolo[2,3-h]quinoline has a molecular weight of 202.64 g/mol, XLogP of 3.37, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-1H-pyrrolo[2,3-h]quinoline is sourced from PubChem (CID 152757444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).