5-[4-(dimethylamino)phenyl]-1H-indazol-3-amine

C15H16N4 — CID 11637416

IUPAC5-[4-(dimethylamino)phenyl]-1H-indazol-3-amine
SMILESCN(C)c1ccc(-c2ccc3[nH]nc(N)c3c2)cc1
InChIInChI=1S/C15H16N4/c1-19(2)12-6-3-10(4-7-12)11-5-8-14-13(9-11)15(16)18-17-14/h3-9H,1-2H3,(H3,16,17,18)
InChIKeyVFRDWMBWEYQLOJ-UHFFFAOYSA-N
MW252.32 g/mol
LogP2.88
Rot. Bonds2

About 5-[4-(dimethylamino)phenyl]-1H-indazol-3-amine

5-[4-(dimethylamino)phenyl]-1H-indazol-3-amine (PubChem CID 11637416) has the molecular formula C15H16N4 and a molecular weight of 252.32 g/mol. Its IUPAC name is 5-[4-(dimethylamino)phenyl]-1H-indazol-3-amine.

Molecular Properties

Compound Name5-[4-(dimethylamino)phenyl]-1H-indazol-3-amine
PubChem CID11637416
Molecular FormulaC15H16N4
Molecular Weight252.32 g/mol
Exact Mass252.14
IUPAC Name5-[4-(dimethylamino)phenyl]-1H-indazol-3-amine
SMILESCN(C)c1ccc(-c2ccc3[nH]nc(N)c3c2)cc1
InChIInChI=1S/C15H16N4/c1-19(2)12-6-3-10(4-7-12)11-5-8-14-13(9-11)15(16)18-17-14/h3-9H,1-2H3,(H3,16,17,18)
InChIKeyVFRDWMBWEYQLOJ-UHFFFAOYSA-N
XLogP2.88
TPSA57.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 52.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-[4-(dimethylamino)phenyl]-1H-indazol-3-amine?
The IUPAC name of 5-[4-(dimethylamino)phenyl]-1H-indazol-3-amine (CID 11637416) is 5-[4-(dimethylamino)phenyl]-1H-indazol-3-amine.
What is the SMILES notation for 5-[4-(dimethylamino)phenyl]-1H-indazol-3-amine?
The canonical SMILES for 5-[4-(dimethylamino)phenyl]-1H-indazol-3-amine is CN(C)c1ccc(-c2ccc3[nH]nc(N)c3c2)cc1.
What is the InChIKey of 5-[4-(dimethylamino)phenyl]-1H-indazol-3-amine?
The InChIKey is VFRDWMBWEYQLOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4/c1-19(2)12-6-3-10(4-7-12)11-5-8-14-13(9-11)15(16)18-17-14/h3-9H,1-2H3,(H3,16,17,18).
What are the key properties of 5-[4-(dimethylamino)phenyl]-1H-indazol-3-amine?
5-[4-(dimethylamino)phenyl]-1H-indazol-3-amine has a molecular weight of 252.32 g/mol, XLogP of 2.88, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-(dimethylamino)phenyl]-1H-indazol-3-amine is sourced from PubChem (CID 11637416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).