3-amino-6-chlorofuro[3,2-b]pyridine-2-carbaldehyde

C8H5ClN2O2 — CID 142922578

IUPAC3-amino-6-chlorofuro[3,2-b]pyridine-2-carbaldehyde
SMILESNc1c(C=O)oc2cc(Cl)cnc12
InChIInChI=1S/C8H5ClN2O2/c9-4-1-5-8(11-2-4)7(10)6(3-12)13-5/h1-3H,10H2
InChIKeyHZAMIWVVPDNZSB-UHFFFAOYSA-N
MW196.59 g/mol
LogP1.88
Rot. Bonds1

About 3-amino-6-chlorofuro[3,2-b]pyridine-2-carbaldehyde

3-amino-6-chlorofuro[3,2-b]pyridine-2-carbaldehyde (PubChem CID 142922578) has the molecular formula C8H5ClN2O2 and a molecular weight of 196.59 g/mol. Its IUPAC name is 3-amino-6-chlorofuro[3,2-b]pyridine-2-carbaldehyde.

Molecular Properties

Compound Name3-amino-6-chlorofuro[3,2-b]pyridine-2-carbaldehyde
PubChem CID142922578
Molecular FormulaC8H5ClN2O2
Molecular Weight196.59 g/mol
Exact Mass196.00
IUPAC Name3-amino-6-chlorofuro[3,2-b]pyridine-2-carbaldehyde
SMILESNc1c(C=O)oc2cc(Cl)cnc12
InChIInChI=1S/C8H5ClN2O2/c9-4-1-5-8(11-2-4)7(10)6(3-12)13-5/h1-3H,10H2
InChIKeyHZAMIWVVPDNZSB-UHFFFAOYSA-N
XLogP1.88
TPSA69.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.59
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

2-amino-4-chloro-1,3-oxazole-5-carbaldehyde
CID 83815274
7-chloro-3-hydroxy-2-[4-(trifluoromethyl)phenyl]pyrano[3,2-b]pyridin-4-one
CID 129138636
5-(3-chloroquinolin-8-yl)furan-2-carbaldehyde
CID 169332397
5-chloro-3-iodopyridine-2-carbaldehyde
CID 131589570
6-chloro-3-pyrimidin-5-ylfuro[3,2-b]pyridine
CID 171512492
6-chloro-2-cyclohexyl-3-iodofuro[3,2-b]pyridine
CID 171512500
[3-(6-chlorofuro[3,2-b]pyridin-3-yl)phenyl]urea
CID 171471574
2-formyl-N,N-dimethyl-3-(methylamino)furo[3,2-b]pyridine-6-carboxamide
CID 142922482
2,5-dichloropyridin-3-amine
CID 2799999
6-chloro-3-(furan-3-yl)furo[3,2-b]pyridine
CID 171471491
5-chloro-3-(3,5-dichlorophenyl)pyridine-2-carbaldehyde
CID 133088128
2-amino-5-(2,4,6-trichlorophenyl)pyridine-3-carbaldehyde
CID 119014537

Frequently Asked Questions

What is the IUPAC name of 3-amino-6-chlorofuro[3,2-b]pyridine-2-carbaldehyde?
The IUPAC name of 3-amino-6-chlorofuro[3,2-b]pyridine-2-carbaldehyde (CID 142922578) is 3-amino-6-chlorofuro[3,2-b]pyridine-2-carbaldehyde.
What is the SMILES notation for 3-amino-6-chlorofuro[3,2-b]pyridine-2-carbaldehyde?
The canonical SMILES for 3-amino-6-chlorofuro[3,2-b]pyridine-2-carbaldehyde is Nc1c(C=O)oc2cc(Cl)cnc12.
What is the InChIKey of 3-amino-6-chlorofuro[3,2-b]pyridine-2-carbaldehyde?
The InChIKey is HZAMIWVVPDNZSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5ClN2O2/c9-4-1-5-8(11-2-4)7(10)6(3-12)13-5/h1-3H,10H2.
What are the key properties of 3-amino-6-chlorofuro[3,2-b]pyridine-2-carbaldehyde?
3-amino-6-chlorofuro[3,2-b]pyridine-2-carbaldehyde has a molecular weight of 196.59 g/mol, XLogP of 1.88, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-6-chlorofuro[3,2-b]pyridine-2-carbaldehyde is sourced from PubChem (CID 142922578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).