N-phenyl-1H-indazol-3-amine

C13H11N3 — CID 12890113

IUPACN-phenyl-1H-indazol-3-amine
SMILESc1ccc(Nc2n[nH]c3ccccc23)cc1
InChIInChI=1S/C13H11N3/c1-2-6-10(7-3-1)14-13-11-8-4-5-9-12(11)15-16-13/h1-9H,(H2,14,15,16)
InChIKeyMWKZLAQDGRSBHS-UHFFFAOYSA-N
MW209.25 g/mol
LogP3.31
Rot. Bonds2

About N-phenyl-1H-indazol-3-amine

N-phenyl-1H-indazol-3-amine (PubChem CID 12890113) has the molecular formula C13H11N3 and a molecular weight of 209.25 g/mol. Its IUPAC name is N-phenyl-1H-indazol-3-amine.

Molecular Properties

Compound NameN-phenyl-1H-indazol-3-amine
PubChem CID12890113
Molecular FormulaC13H11N3
Molecular Weight209.25 g/mol
Exact Mass209.10
IUPAC NameN-phenyl-1H-indazol-3-amine
SMILESc1ccc(Nc2n[nH]c3ccccc23)cc1
InChIInChI=1S/C13H11N3/c1-2-6-10(7-3-1)14-13-11-8-4-5-9-12(11)15-16-13/h1-9H,(H2,14,15,16)
InChIKeyMWKZLAQDGRSBHS-UHFFFAOYSA-N
XLogP3.31
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 53.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1H-indazol-3-amine
CID 13399
N-(5-phenyl-1H-indazol-3-yl)butanamide
CID 6539551
N-(6-phenyl-1H-indazol-3-yl)cyclopropanecarboxamide
CID 6539593
N-(6-phenyl-1H-indazol-3-yl)butyramide
CID 10085013
Phenyl-(3-phenyl-1H-indazol-6-yl)-amine
CID 10236389
5-phenyl-1H-indazol-3-amine
CID 11492186
3,5-Dianilinopyrazole
CID 2322334
N-(6-benzyl-1H-indazol-3-yl)butyramide
CID 10266409
(E)-N-(6-(prop-1-enyl)-1H-indazol-3-yl)butyramide
CID 22319483
N-(6-phenethyl-1H-indazol-3-yl)butyramide
CID 22319484
N2-(5-phenyl-1H-pyrazol-3-yl)benzene-1,2-diamine
CID 2423957
4-N-(4-methylphenyl)-1H-pyrazolo[4,5-c]quinoline-3,4-diamine
CID 11140796

Frequently Asked Questions

What is the IUPAC name of N-phenyl-1H-indazol-3-amine?
The IUPAC name of N-phenyl-1H-indazol-3-amine (CID 12890113) is N-phenyl-1H-indazol-3-amine.
What is the SMILES notation for N-phenyl-1H-indazol-3-amine?
The canonical SMILES for N-phenyl-1H-indazol-3-amine is c1ccc(Nc2n[nH]c3ccccc23)cc1.
What is the InChIKey of N-phenyl-1H-indazol-3-amine?
The InChIKey is MWKZLAQDGRSBHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N3/c1-2-6-10(7-3-1)14-13-11-8-4-5-9-12(11)15-16-13/h1-9H,(H2,14,15,16).
What are the key properties of N-phenyl-1H-indazol-3-amine?
N-phenyl-1H-indazol-3-amine has a molecular weight of 209.25 g/mol, XLogP of 3.31, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-1H-indazol-3-amine is sourced from PubChem (CID 12890113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).