1-nonylindazol-3-amine

C16H25N3 — CID 63489930

IUPAC1-nonylindazol-3-amine
SMILESCCCCCCCCCn1nc(N)c2ccccc21
InChIInChI=1S/C16H25N3/c1-2-3-4-5-6-7-10-13-19-15-12-9-8-11-14(15)16(17)18-19/h8-9,11-12H,2-7,10,13H2,1H3,(H2,17,18)
InChIKeyWISUGTCKMTZZRS-UHFFFAOYSA-N
MW259.40 g/mol
LogP4.37
Rot. Bonds8

About 1-nonylindazol-3-amine

1-nonylindazol-3-amine (PubChem CID 63489930) has the molecular formula C16H25N3 and a molecular weight of 259.40 g/mol. Its IUPAC name is 1-nonylindazol-3-amine.

Molecular Properties

Compound Name1-nonylindazol-3-amine
PubChem CID63489930
Molecular FormulaC16H25N3
Molecular Weight259.40 g/mol
Exact Mass259.20
IUPAC Name1-nonylindazol-3-amine
SMILESCCCCCCCCCn1nc(N)c2ccccc21
InChIInChI=1S/C16H25N3/c1-2-3-4-5-6-7-10-13-19-15-12-9-8-11-14(15)16(17)18-19/h8-9,11-12H,2-7,10,13H2,1H3,(H2,17,18)
InChIKeyWISUGTCKMTZZRS-UHFFFAOYSA-N
XLogP4.37
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.40
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-butylindazol-3-amine
CID 62686774
1-[2-(diethylamino)ethyl]indazol-3-amine
CID 107913543
1-(3-phenylpropyl)indazol-3-amine
CID 62687133
1-(2-ethoxyethyl)indazol-3-amine
CID 62687666
1-(2-pyrazol-1-ylethyl)indazol-3-amine
CID 62687152
1-(2-tert-butylsulfonylethyl)indazol-3-amine
CID 106729521
9-hexadecylcarbazole
CID 4166588
9-docosylcarbazole
CID 10528568
benzene;9-octylcarbazole
CID 175067369
1-tridecylbenzotriazole
CID 21059042
1-[(3,5-dimethylphenyl)methyl]indazol-3-amine
CID 62685871
ethane;3-methyl-1-propylindazole
CID 144653830

Frequently Asked Questions

What is the IUPAC name of 1-nonylindazol-3-amine?
The IUPAC name of 1-nonylindazol-3-amine (CID 63489930) is 1-nonylindazol-3-amine.
What is the SMILES notation for 1-nonylindazol-3-amine?
The canonical SMILES for 1-nonylindazol-3-amine is CCCCCCCCCn1nc(N)c2ccccc21.
What is the InChIKey of 1-nonylindazol-3-amine?
The InChIKey is WISUGTCKMTZZRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3/c1-2-3-4-5-6-7-10-13-19-15-12-9-8-11-14(15)16(17)18-19/h8-9,11-12H,2-7,10,13H2,1H3,(H2,17,18).
What are the key properties of 1-nonylindazol-3-amine?
1-nonylindazol-3-amine has a molecular weight of 259.40 g/mol, XLogP of 4.37, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-nonylindazol-3-amine is sourced from PubChem (CID 63489930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).