5,6-dichloro-N-(1H-indazol-5-yl)pyridine-3-carboxamide

C13H8Cl2N4O — CID 60712400

IUPAC5,6-dichloro-N-(1H-indazol-5-yl)pyridine-3-carboxamide
SMILESO=C(Nc1ccc2[nH]ncc2c1)c1cnc(Cl)c(Cl)c1
InChIInChI=1S/C13H8Cl2N4O/c14-10-4-8(5-16-12(10)15)13(20)18-9-1-2-11-7(3-9)6-17-19-11/h1-6H,(H,17,19)(H,18,20)
InChIKeyNNYARVUWYSYVPO-UHFFFAOYSA-N
MW307.14 g/mol
LogP3.52
Rot. Bonds2

About 5,6-dichloro-N-(1H-indazol-5-yl)pyridine-3-carboxamide

5,6-dichloro-N-(1H-indazol-5-yl)pyridine-3-carboxamide (PubChem CID 60712400) has the molecular formula C13H8Cl2N4O and a molecular weight of 307.14 g/mol. Its IUPAC name is 5,6-dichloro-N-(1H-indazol-5-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5,6-dichloro-N-(1H-indazol-5-yl)pyridine-3-carboxamide
PubChem CID60712400
Molecular FormulaC13H8Cl2N4O
Molecular Weight307.14 g/mol
Exact Mass306.01
IUPAC Name5,6-dichloro-N-(1H-indazol-5-yl)pyridine-3-carboxamide
SMILESO=C(Nc1ccc2[nH]ncc2c1)c1cnc(Cl)c(Cl)c1
InChIInChI=1S/C13H8Cl2N4O/c14-10-4-8(5-16-12(10)15)13(20)18-9-1-2-11-7(3-9)6-17-19-11/h1-6H,(H,17,19)(H,18,20)
InChIKeyNNYARVUWYSYVPO-UHFFFAOYSA-N
XLogP3.52
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.14
LogP ≤ 53.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-chloro-N-(1H-indazol-5-yl)-4-iodobenzamide
CID 103221440
N-(1H-indazol-5-yl)-4-methylbenzamide
CID 17163732
1-(3,4-dichlorophenyl)-3-(1H-indazol-5-yl)urea
CID 4607305
N-naphthalen-2-yl-1H-indazole-5-carboxamide
CID 69422881
N-(3-bromophenyl)-5,6-dichloropyridine-3-carboxamide
CID 2095074
N-(4-carbamoylphenyl)-5,6-dichloropyridine-3-carboxamide
CID 7760364
N-(1H-indazol-5-yl)-2H-benzotriazole-5-carboxamide
CID 110468858
3-chloro-N-(1H-indazol-5-yl)-4-(3-methoxy-2-pyridinyl)benzamide
CID 59673395
2-fluoro-N-(1H-indazol-5-yl)benzamide
CID 5078247
1-(2-chloro-4-pyridinyl)-3-(1H-indazol-5-yl)urea
CID 150071160
(E)-3-(4-chlorophenyl)-N-(1H-indazol-5-yl)prop-2-enamide
CID 17164818
5,6-dichloro-N-(4-cyanophenyl)pyridine-3-carboxamide
CID 2477549

Frequently Asked Questions

What is the IUPAC name of 5,6-dichloro-N-(1H-indazol-5-yl)pyridine-3-carboxamide?
The IUPAC name of 5,6-dichloro-N-(1H-indazol-5-yl)pyridine-3-carboxamide (CID 60712400) is 5,6-dichloro-N-(1H-indazol-5-yl)pyridine-3-carboxamide.
What is the SMILES notation for 5,6-dichloro-N-(1H-indazol-5-yl)pyridine-3-carboxamide?
The canonical SMILES for 5,6-dichloro-N-(1H-indazol-5-yl)pyridine-3-carboxamide is O=C(Nc1ccc2[nH]ncc2c1)c1cnc(Cl)c(Cl)c1.
What is the InChIKey of 5,6-dichloro-N-(1H-indazol-5-yl)pyridine-3-carboxamide?
The InChIKey is NNYARVUWYSYVPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8Cl2N4O/c14-10-4-8(5-16-12(10)15)13(20)18-9-1-2-11-7(3-9)6-17-19-11/h1-6H,(H,17,19)(H,18,20).
What are the key properties of 5,6-dichloro-N-(1H-indazol-5-yl)pyridine-3-carboxamide?
5,6-dichloro-N-(1H-indazol-5-yl)pyridine-3-carboxamide has a molecular weight of 307.14 g/mol, XLogP of 3.52, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dichloro-N-(1H-indazol-5-yl)pyridine-3-carboxamide is sourced from PubChem (CID 60712400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).