3-chloro-7-fluoro-1H-pyrrolo[2,3-c]pyridine

C7H4ClFN2 — CID 53412664

IUPAC3-chloro-7-fluoro-1H-pyrrolo[2,3-c]pyridine
SMILESFc1nccc2c(Cl)c[nH]c12
InChIInChI=1S/C7H4ClFN2/c8-5-3-11-6-4(5)1-2-10-7(6)9/h1-3,11H
InChIKeyNVPUMGQHGOFESN-UHFFFAOYSA-N
MW170.57 g/mol
LogP2.36
Rot. Bonds

About 3-chloro-7-fluoro-1H-pyrrolo[2,3-c]pyridine

3-chloro-7-fluoro-1H-pyrrolo[2,3-c]pyridine (PubChem CID 53412664) has the molecular formula C7H4ClFN2 and a molecular weight of 170.57 g/mol. Its IUPAC name is 3-chloro-7-fluoro-1H-pyrrolo[2,3-c]pyridine.

Molecular Properties

Compound Name3-chloro-7-fluoro-1H-pyrrolo[2,3-c]pyridine
PubChem CID53412664
Molecular FormulaC7H4ClFN2
Molecular Weight170.57 g/mol
Exact Mass170.00
IUPAC Name3-chloro-7-fluoro-1H-pyrrolo[2,3-c]pyridine
SMILESFc1nccc2c(Cl)c[nH]c12
InChIInChI=1S/C7H4ClFN2/c8-5-3-11-6-4(5)1-2-10-7(6)9/h1-3,11H
InChIKeyNVPUMGQHGOFESN-UHFFFAOYSA-N
XLogP2.36
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.57
LogP ≤ 52.36
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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Related Compounds

3,7-dichloro-1H-pyrrolo[2,3-c]pyridine
CID 53412470
7-fluoro-1H-pyrrolo[2,3-c]pyridine
CID 53413170
3-fluoro-7-methoxy-1H-pyrrolo[2,3-c]pyridine
CID 123135186
4-(3-chloro-1H-indol-7-yl)-1-methylpyrazol-5-amine
CID 117369275
(3-chloro-1H-indol-7-yl)methanol
CID 84658243
8-chloro-3-methyl-1H-1,7-naphthyridin-4-one
CID 129293771
7-chloro-1H-pyrrolo[2,3-c]pyridine-3-sulfonyl chloride
CID 91619175
3-(2,6-dichlorophenyl)-2,4-difluoropyridine
CID 133090559
(9-methyl-3-oxa-9-azabicyclo[3.3.1]nonan-7-yl) 7-fluoro-1H-pyrrolo[2,3-c]pyridine-3-carboxylate
CID 118436216
CID 87288277
CID 87288277
6-chloro-5-fluoroisoquinolin-1-amine
CID 114489502
N-[(3-chloro-1H-indol-7-yl)methyl]hydroxylamine
CID 117286523

Frequently Asked Questions

What is the IUPAC name of 3-chloro-7-fluoro-1H-pyrrolo[2,3-c]pyridine?
The IUPAC name of 3-chloro-7-fluoro-1H-pyrrolo[2,3-c]pyridine (CID 53412664) is 3-chloro-7-fluoro-1H-pyrrolo[2,3-c]pyridine.
What is the SMILES notation for 3-chloro-7-fluoro-1H-pyrrolo[2,3-c]pyridine?
The canonical SMILES for 3-chloro-7-fluoro-1H-pyrrolo[2,3-c]pyridine is Fc1nccc2c(Cl)c[nH]c12.
What is the InChIKey of 3-chloro-7-fluoro-1H-pyrrolo[2,3-c]pyridine?
The InChIKey is NVPUMGQHGOFESN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4ClFN2/c8-5-3-11-6-4(5)1-2-10-7(6)9/h1-3,11H.
What are the key properties of 3-chloro-7-fluoro-1H-pyrrolo[2,3-c]pyridine?
3-chloro-7-fluoro-1H-pyrrolo[2,3-c]pyridine has a molecular weight of 170.57 g/mol, XLogP of 2.36, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-7-fluoro-1H-pyrrolo[2,3-c]pyridine is sourced from PubChem (CID 53412664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).