1-[(1-propan-2-ylpyrazol-3-yl)methyl]indazol-3-amine

C14H17N5 — CID 64773024

IUPAC1-[(1-propan-2-ylpyrazol-3-yl)methyl]indazol-3-amine
SMILESCC(C)n1ccc(Cn2nc(N)c3ccccc32)n1
InChIInChI=1S/C14H17N5/c1-10(2)18-8-7-11(16-18)9-19-13-6-4-3-5-12(13)14(15)17-19/h3-8,10H,9H2,1-2H3,(H2,15,17)
InChIKeyFZHRMELXXYTRKB-UHFFFAOYSA-N
MW255.33 g/mol
LogP2.44
Rot. Bonds3

About 1-[(1-propan-2-ylpyrazol-3-yl)methyl]indazol-3-amine

1-[(1-propan-2-ylpyrazol-3-yl)methyl]indazol-3-amine (PubChem CID 64773024) has the molecular formula C14H17N5 and a molecular weight of 255.33 g/mol. Its IUPAC name is 1-[(1-propan-2-ylpyrazol-3-yl)methyl]indazol-3-amine.

Molecular Properties

Compound Name1-[(1-propan-2-ylpyrazol-3-yl)methyl]indazol-3-amine
PubChem CID64773024
Molecular FormulaC14H17N5
Molecular Weight255.33 g/mol
Exact Mass255.15
IUPAC Name1-[(1-propan-2-ylpyrazol-3-yl)methyl]indazol-3-amine
SMILESCC(C)n1ccc(Cn2nc(N)c3ccccc32)n1
InChIInChI=1S/C14H17N5/c1-10(2)18-8-7-11(16-18)9-19-13-6-4-3-5-12(13)14(15)17-19/h3-8,10H,9H2,1-2H3,(H2,15,17)
InChIKeyFZHRMELXXYTRKB-UHFFFAOYSA-N
XLogP2.44
TPSA61.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.33
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[(1-propan-2-ylpyrazol-3-yl)methyl]indazole-3-carboxylic acid
CID 64771668
1-[(3,5-dimethylphenyl)methyl]indazol-3-amine
CID 62685871
1-[(2-chlorophenyl)methyl]indazol-3-amine
CID 55104008
[1-[(1-propan-2-ylpyrazol-3-yl)methyl]indol-2-yl]methanamine
CID 64799410
1-butylindazol-3-amine
CID 62686774
1-[2-(diethylamino)ethyl]indazol-3-amine
CID 107913543
4-chloro-1-[(1-propan-2-ylpyrazol-3-yl)methyl]indole
CID 116623519
4-fluoro-1-[(1-propan-2-ylpyrazol-3-yl)methyl]indole
CID 82792719
[3,5-dimethyl-1-[(1-propan-2-ylpyrazol-3-yl)methyl]pyrazol-4-yl]methanamine
CID 64773488
1-(2-pyrazol-1-ylethyl)indazol-3-amine
CID 62687152
2-[(1-propan-2-ylpyrazol-3-yl)methyl]isoindole-1,3-dione
CID 91969599
1-nonylindazol-3-amine
CID 63489930

Frequently Asked Questions

What is the IUPAC name of 1-[(1-propan-2-ylpyrazol-3-yl)methyl]indazol-3-amine?
The IUPAC name of 1-[(1-propan-2-ylpyrazol-3-yl)methyl]indazol-3-amine (CID 64773024) is 1-[(1-propan-2-ylpyrazol-3-yl)methyl]indazol-3-amine.
What is the SMILES notation for 1-[(1-propan-2-ylpyrazol-3-yl)methyl]indazol-3-amine?
The canonical SMILES for 1-[(1-propan-2-ylpyrazol-3-yl)methyl]indazol-3-amine is CC(C)n1ccc(Cn2nc(N)c3ccccc32)n1.
What is the InChIKey of 1-[(1-propan-2-ylpyrazol-3-yl)methyl]indazol-3-amine?
The InChIKey is FZHRMELXXYTRKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5/c1-10(2)18-8-7-11(16-18)9-19-13-6-4-3-5-12(13)14(15)17-19/h3-8,10H,9H2,1-2H3,(H2,15,17).
What are the key properties of 1-[(1-propan-2-ylpyrazol-3-yl)methyl]indazol-3-amine?
1-[(1-propan-2-ylpyrazol-3-yl)methyl]indazol-3-amine has a molecular weight of 255.33 g/mol, XLogP of 2.44, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1-propan-2-ylpyrazol-3-yl)methyl]indazol-3-amine is sourced from PubChem (CID 64773024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).