4-(1,3-dimethylindazol-4-yl)-1H-pyrazol-5-amine

C12H13N5 — CID 117327028

IUPAC4-(1,3-dimethylindazol-4-yl)-1H-pyrazol-5-amine
SMILESCc1nn(C)c2cccc(-c3cn[nH]c3N)c12
InChIInChI=1S/C12H13N5/c1-7-11-8(9-6-14-15-12(9)13)4-3-5-10(11)17(2)16-7/h3-6H,1-2H3,(H3,13,14,15)
InChIKeyWFRULNWBXORMPN-UHFFFAOYSA-N
MW227.27 g/mol
LogP1.85
Rot. Bonds1

About 4-(1,3-dimethylindazol-4-yl)-1H-pyrazol-5-amine

4-(1,3-dimethylindazol-4-yl)-1H-pyrazol-5-amine (PubChem CID 117327028) has the molecular formula C12H13N5 and a molecular weight of 227.27 g/mol. Its IUPAC name is 4-(1,3-dimethylindazol-4-yl)-1H-pyrazol-5-amine.

Molecular Properties

Compound Name4-(1,3-dimethylindazol-4-yl)-1H-pyrazol-5-amine
PubChem CID117327028
Molecular FormulaC12H13N5
Molecular Weight227.27 g/mol
Exact Mass227.12
IUPAC Name4-(1,3-dimethylindazol-4-yl)-1H-pyrazol-5-amine
SMILESCc1nn(C)c2cccc(-c3cn[nH]c3N)c12
InChIInChI=1S/C12H13N5/c1-7-11-8(9-6-14-15-12(9)13)4-3-5-10(11)17(2)16-7/h3-6H,1-2H3,(H3,13,14,15)
InChIKeyWFRULNWBXORMPN-UHFFFAOYSA-N
XLogP1.85
TPSA72.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.27
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1,3-dimethyl-4-propan-2-ylindazole;ethane
CID 144655945
4-(3-chloro-1H-indol-4-yl)-1H-pyrazol-5-amine
CID 117337235
4-(5-amino-1H-pyrazol-4-yl)-1-methyl-3H-indol-2-one
CID 117328790
4-(3-chloro-1-methylindazol-6-yl)-1H-pyrazol-5-amine
CID 117372451
4-[2-(1-methyl-4,5-dihydroimidazol-2-yl)phenyl]-1H-pyrazol-5-amine
CID 117355369
1,3-dimethylpyrazolo[4,5-c]pyridin-4-amine;ethane
CID 155748773
4-(2-fluoro-3-methoxyphenyl)-1H-pyrazol-5-amine
CID 117295549
4-(3-chloro-2-fluorophenyl)-1H-pyrazol-5-amine
CID 82803223
2-(5-amino-1H-pyrazol-4-yl)-4,5-dimethylphenol
CID 117291747
4-(7-chloro-1-methylbenzimidazol-2-yl)-1H-pyrazol-5-amine
CID 54920303
4-(7-fluoro-1-methylbenzimidazol-2-yl)-1H-pyrazol-5-amine
CID 112741020
2-(1,3-dimethylindazol-4-yl)-2-oxoacetic acid
CID 117310594

Frequently Asked Questions

What is the IUPAC name of 4-(1,3-dimethylindazol-4-yl)-1H-pyrazol-5-amine?
The IUPAC name of 4-(1,3-dimethylindazol-4-yl)-1H-pyrazol-5-amine (CID 117327028) is 4-(1,3-dimethylindazol-4-yl)-1H-pyrazol-5-amine.
What is the SMILES notation for 4-(1,3-dimethylindazol-4-yl)-1H-pyrazol-5-amine?
The canonical SMILES for 4-(1,3-dimethylindazol-4-yl)-1H-pyrazol-5-amine is Cc1nn(C)c2cccc(-c3cn[nH]c3N)c12.
What is the InChIKey of 4-(1,3-dimethylindazol-4-yl)-1H-pyrazol-5-amine?
The InChIKey is WFRULNWBXORMPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N5/c1-7-11-8(9-6-14-15-12(9)13)4-3-5-10(11)17(2)16-7/h3-6H,1-2H3,(H3,13,14,15).
What are the key properties of 4-(1,3-dimethylindazol-4-yl)-1H-pyrazol-5-amine?
4-(1,3-dimethylindazol-4-yl)-1H-pyrazol-5-amine has a molecular weight of 227.27 g/mol, XLogP of 1.85, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1,3-dimethylindazol-4-yl)-1H-pyrazol-5-amine is sourced from PubChem (CID 117327028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).