6-fluoro-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine;molecular hydrogen

C7H9FN2 — CID 142308839

IUPAC6-fluoro-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine;molecular hydrogen
SMILESFC1CC=c2cc[nH]c2=N1.[H][H]
InChIInChI=1S/C7H7FN2.H2/c8-6-2-1-5-3-4-9-7(5)10-6;/h1,3-4,6H,2H2,(H,9,10);1H
InChIKeyDLPVRMHGEYWTIX-UHFFFAOYSA-N
MW140.16 g/mol
LogP0.36
Rot. Bonds

About 6-fluoro-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine;molecular hydrogen

6-fluoro-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine;molecular hydrogen (PubChem CID 142308839) has the molecular formula C7H9FN2 and a molecular weight of 140.16 g/mol. Its IUPAC name is 6-fluoro-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine;molecular hydrogen.

Molecular Properties

Compound Name6-fluoro-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine;molecular hydrogen
PubChem CID142308839
Molecular FormulaC7H9FN2
Molecular Weight140.16 g/mol
Exact Mass140.07
IUPAC Name6-fluoro-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine;molecular hydrogen
SMILESFC1CC=c2cc[nH]c2=N1.[H][H]
InChIInChI=1S/C7H7FN2.H2/c8-6-2-1-5-3-4-9-7(5)10-6;/h1,3-4,6H,2H2,(H,9,10);1H
InChIKeyDLPVRMHGEYWTIX-UHFFFAOYSA-N
XLogP0.36
TPSA28.15 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.16
LogP ≤ 50.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-C-halo', 'substructure': 'N/A'}

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Related Compounds

5,6-Dihydro-7-azaindole
CID 70639991
2-(5,6-dihydro-1H-pyrrolo[2,3-b]pyridin-3-yl)-5-fluoro-1,4-dihydropyrimidin-6-amine
CID 68101768
4-(2-fluoro-1,2-dihydropyridin-6-yl)-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine
CID 88909184
4-fluoro-3,5-dimethyl-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine
CID 124026877
6-fluoro-2-iodo-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine
CID 134376306
3-methyl-5-(trifluoromethyl)-5,6-dihydro-1H-pyrrolo[2,3-b]pyridin-1-ium
CID 163621742
N-[(Z)-2-fluoroethenyl]-N'-methyl-1,2,3,6-tetrahydropyridine-4-carboximidamide
CID 166762632
(3Z)-3-ethylidene-N-(1-fluoroethyl)-1H-pyrrol-2-imine
CID 173810774
(3Z)-3-ethylidene-N-(fluoromethyl)-1H-pyrrol-2-imine
CID 173891209
6-fluoro-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine
CID 142308840
N-[(E)-2-fluoroprop-1-enyl]-3-methylidene-1H-pyrrol-2-imine
CID 145149501
3-methyl-5-(trifluoromethyl)-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine
CID 163621743

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine;molecular hydrogen?
The IUPAC name of 6-fluoro-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine;molecular hydrogen (CID 142308839) is 6-fluoro-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine;molecular hydrogen.
What is the SMILES notation for 6-fluoro-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine;molecular hydrogen?
The canonical SMILES for 6-fluoro-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine;molecular hydrogen is FC1CC=c2cc[nH]c2=N1.[H][H].
What is the InChIKey of 6-fluoro-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine;molecular hydrogen?
The InChIKey is DLPVRMHGEYWTIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7FN2.H2/c8-6-2-1-5-3-4-9-7(5)10-6;/h1,3-4,6H,2H2,(H,9,10);1H.
What are the key properties of 6-fluoro-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine;molecular hydrogen?
6-fluoro-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine;molecular hydrogen has a molecular weight of 140.16 g/mol, XLogP of 0.36, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine;molecular hydrogen is sourced from PubChem (CID 142308839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).