6-chloro-5-phenyl-1H-indazol-3-amine

C13H10ClN3 — CID 22319601

IUPAC6-chloro-5-phenyl-1H-indazol-3-amine
SMILESNc1n[nH]c2cc(Cl)c(-c3ccccc3)cc12
InChIInChI=1S/C13H10ClN3/c14-11-7-12-10(13(15)17-16-12)6-9(11)8-4-2-1-3-5-8/h1-7H,(H3,15,16,17)
InChIKeyUEXRYENIFBGPGX-UHFFFAOYSA-N
MW243.70 g/mol
LogP3.47
Rot. Bonds1

About 6-chloro-5-phenyl-1H-indazol-3-amine

6-chloro-5-phenyl-1H-indazol-3-amine (PubChem CID 22319601) has the molecular formula C13H10ClN3 and a molecular weight of 243.70 g/mol. Its IUPAC name is 6-chloro-5-phenyl-1H-indazol-3-amine.

Molecular Properties

Compound Name6-chloro-5-phenyl-1H-indazol-3-amine
PubChem CID22319601
Molecular FormulaC13H10ClN3
Molecular Weight243.70 g/mol
Exact Mass243.06
IUPAC Name6-chloro-5-phenyl-1H-indazol-3-amine
SMILESNc1n[nH]c2cc(Cl)c(-c3ccccc3)cc12
InChIInChI=1S/C13H10ClN3/c14-11-7-12-10(13(15)17-16-12)6-9(11)8-4-2-1-3-5-8/h1-7H,(H3,15,16,17)
InChIKeyUEXRYENIFBGPGX-UHFFFAOYSA-N
XLogP3.47
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.70
LogP ≤ 53.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-5-phenyl-1H-indazol-3-amine?
The IUPAC name of 6-chloro-5-phenyl-1H-indazol-3-amine (CID 22319601) is 6-chloro-5-phenyl-1H-indazol-3-amine.
What is the SMILES notation for 6-chloro-5-phenyl-1H-indazol-3-amine?
The canonical SMILES for 6-chloro-5-phenyl-1H-indazol-3-amine is Nc1n[nH]c2cc(Cl)c(-c3ccccc3)cc12.
What is the InChIKey of 6-chloro-5-phenyl-1H-indazol-3-amine?
The InChIKey is UEXRYENIFBGPGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10ClN3/c14-11-7-12-10(13(15)17-16-12)6-9(11)8-4-2-1-3-5-8/h1-7H,(H3,15,16,17).
What are the key properties of 6-chloro-5-phenyl-1H-indazol-3-amine?
6-chloro-5-phenyl-1H-indazol-3-amine has a molecular weight of 243.70 g/mol, XLogP of 3.47, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-5-phenyl-1H-indazol-3-amine is sourced from PubChem (CID 22319601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).