N-(4,6-dichloro-1H-pyrazolo[4,5-c]pyridin-7-yl)formamide

C7H4Cl2N4O — CID 175298701

IUPACN-(4,6-dichloro-1H-pyrazolo[4,5-c]pyridin-7-yl)formamide
SMILESO=CNc1c(Cl)nc(Cl)c2cn[nH]c12
InChIInChI=1S/C7H4Cl2N4O/c8-6-3-1-11-13-4(3)5(10-2-14)7(9)12-6/h1-2H,(H,10,14)(H,11,13)
InChIKeyCGUSJRDHWWASJZ-UHFFFAOYSA-N
MW231.04 g/mol
LogP1.83
Rot. Bonds2

About N-(4,6-dichloro-1H-pyrazolo[4,5-c]pyridin-7-yl)formamide

N-(4,6-dichloro-1H-pyrazolo[4,5-c]pyridin-7-yl)formamide (PubChem CID 175298701) has the molecular formula C7H4Cl2N4O and a molecular weight of 231.04 g/mol. Its IUPAC name is N-(4,6-dichloro-1H-pyrazolo[4,5-c]pyridin-7-yl)formamide.

Molecular Properties

Compound NameN-(4,6-dichloro-1H-pyrazolo[4,5-c]pyridin-7-yl)formamide
PubChem CID175298701
Molecular FormulaC7H4Cl2N4O
Molecular Weight231.04 g/mol
Exact Mass229.98
IUPAC NameN-(4,6-dichloro-1H-pyrazolo[4,5-c]pyridin-7-yl)formamide
SMILESO=CNc1c(Cl)nc(Cl)c2cn[nH]c12
InChIInChI=1S/C7H4Cl2N4O/c8-6-3-1-11-13-4(3)5(10-2-14)7(9)12-6/h1-2H,(H,10,14)(H,11,13)
InChIKeyCGUSJRDHWWASJZ-UHFFFAOYSA-N
XLogP1.83
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.04
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(4,6-dichloro-1H-pyrazolo[4,5-c]pyridin-7-yl)formamide?
The IUPAC name of N-(4,6-dichloro-1H-pyrazolo[4,5-c]pyridin-7-yl)formamide (CID 175298701) is N-(4,6-dichloro-1H-pyrazolo[4,5-c]pyridin-7-yl)formamide.
What is the SMILES notation for N-(4,6-dichloro-1H-pyrazolo[4,5-c]pyridin-7-yl)formamide?
The canonical SMILES for N-(4,6-dichloro-1H-pyrazolo[4,5-c]pyridin-7-yl)formamide is O=CNc1c(Cl)nc(Cl)c2cn[nH]c12.
What is the InChIKey of N-(4,6-dichloro-1H-pyrazolo[4,5-c]pyridin-7-yl)formamide?
The InChIKey is CGUSJRDHWWASJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4Cl2N4O/c8-6-3-1-11-13-4(3)5(10-2-14)7(9)12-6/h1-2H,(H,10,14)(H,11,13).
What are the key properties of N-(4,6-dichloro-1H-pyrazolo[4,5-c]pyridin-7-yl)formamide?
N-(4,6-dichloro-1H-pyrazolo[4,5-c]pyridin-7-yl)formamide has a molecular weight of 231.04 g/mol, XLogP of 1.83, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,6-dichloro-1H-pyrazolo[4,5-c]pyridin-7-yl)formamide is sourced from PubChem (CID 175298701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).