7-chloro-5-nitro-2,3-dihydrofuro[2,3-c]pyridine

C7H5ClN2O3 — CID 10536056

IUPAC7-chloro-5-nitro-2,3-dihydrofuro[2,3-c]pyridine
SMILESO=[N+]([O-])c1cc2c(c(Cl)n1)OCC2
InChIInChI=1S/C7H5ClN2O3/c8-7-6-4(1-2-13-6)3-5(9-7)10(11)12/h3H,1-2H2
InChIKeyGGJRZXQENSBZAA-UHFFFAOYSA-N
MW200.58 g/mol
LogP1.58
Rot. Bonds1

About 7-chloro-5-nitro-2,3-dihydrofuro[2,3-c]pyridine

7-chloro-5-nitro-2,3-dihydrofuro[2,3-c]pyridine (PubChem CID 10536056) has the molecular formula C7H5ClN2O3 and a molecular weight of 200.58 g/mol. Its IUPAC name is 7-chloro-5-nitro-2,3-dihydrofuro[2,3-c]pyridine.

Molecular Properties

Compound Name7-chloro-5-nitro-2,3-dihydrofuro[2,3-c]pyridine
PubChem CID10536056
Molecular FormulaC7H5ClN2O3
Molecular Weight200.58 g/mol
Exact Mass200.00
IUPAC Name7-chloro-5-nitro-2,3-dihydrofuro[2,3-c]pyridine
SMILESO=[N+]([O-])c1cc2c(c(Cl)n1)OCC2
InChIInChI=1S/C7H5ClN2O3/c8-7-6-4(1-2-13-6)3-5(9-7)10(11)12/h3H,1-2H2
InChIKeyGGJRZXQENSBZAA-UHFFFAOYSA-N
XLogP1.58
TPSA65.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.58
LogP ≤ 51.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

7-bromo-5-nitro-2,3-dihydro-1-benzofuran
CID 18787034
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2,4-dichloro-6-nitropyrimidine
CID 19391209
7-fluoro-2,3-dihydro-1-benzofuran-5-amine;7-fluoro-5-nitro-2,3-dihydro-1-benzofuran
CID 159692780
6-chloro-8-nitro-2,3-dihydrochromen-4-one
CID 130038992
5-bromo-N-(5-chloro-2-hydroxy-3-nitrophenyl)-2,3-dihydro-1-benzofuran-7-sulfonamide
CID 155598020
7-chloro-5-nitrofuro[3,2-b]pyridine
CID 167359993
2-chloro-3-(difluoromethyl)-6-nitropyridin-4-amine
CID 118851730
9-bromo-2-methyl-7-nitro-4,5-dihydro-[1]benzoxepino[5,4-c]pyrazole
CID 171626366
2-chloro-3-fluoro-6-nitropyridine
CID 119018246
4-chloro-2-iodo-6-nitropyridine
CID 118839728
5-chloro-2,3-dihydro-1-benzofuran-7-sulfonyl fluoride
CID 165461315

Frequently Asked Questions

What is the IUPAC name of 7-chloro-5-nitro-2,3-dihydrofuro[2,3-c]pyridine?
The IUPAC name of 7-chloro-5-nitro-2,3-dihydrofuro[2,3-c]pyridine (CID 10536056) is 7-chloro-5-nitro-2,3-dihydrofuro[2,3-c]pyridine.
What is the SMILES notation for 7-chloro-5-nitro-2,3-dihydrofuro[2,3-c]pyridine?
The canonical SMILES for 7-chloro-5-nitro-2,3-dihydrofuro[2,3-c]pyridine is O=[N+]([O-])c1cc2c(c(Cl)n1)OCC2.
What is the InChIKey of 7-chloro-5-nitro-2,3-dihydrofuro[2,3-c]pyridine?
The InChIKey is GGJRZXQENSBZAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5ClN2O3/c8-7-6-4(1-2-13-6)3-5(9-7)10(11)12/h3H,1-2H2.
What are the key properties of 7-chloro-5-nitro-2,3-dihydrofuro[2,3-c]pyridine?
7-chloro-5-nitro-2,3-dihydrofuro[2,3-c]pyridine has a molecular weight of 200.58 g/mol, XLogP of 1.58, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-5-nitro-2,3-dihydrofuro[2,3-c]pyridine is sourced from PubChem (CID 10536056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).