N-ethyl-1-phenyl-[1,2,4]triazolo[1,5-b]indazol-2-amine

C16H15N5 — CID 14639449

IUPACN-ethyl-1-phenyl-[1,2,4]triazolo[1,5-b]indazol-2-amine
SMILESCCNc1nn2nc3ccccc3c2n1-c1ccccc1
InChIInChI=1S/C16H15N5/c1-2-17-16-19-21-15(13-10-6-7-11-14(13)18-21)20(16)12-8-4-3-5-9-12/h3-11H,2H2,1H3,(H,17,19)
InChIKeyNNUAQERFPHWXJC-UHFFFAOYSA-N
MW277.33 g/mol
LogP3.11
Rot. Bonds3

About N-ethyl-1-phenyl-[1,2,4]triazolo[1,5-b]indazol-2-amine

N-ethyl-1-phenyl-[1,2,4]triazolo[1,5-b]indazol-2-amine (PubChem CID 14639449) has the molecular formula C16H15N5 and a molecular weight of 277.33 g/mol. Its IUPAC name is N-ethyl-1-phenyl-[1,2,4]triazolo[1,5-b]indazol-2-amine.

Molecular Properties

Compound NameN-ethyl-1-phenyl-[1,2,4]triazolo[1,5-b]indazol-2-amine
PubChem CID14639449
Molecular FormulaC16H15N5
Molecular Weight277.33 g/mol
Exact Mass277.13
IUPAC NameN-ethyl-1-phenyl-[1,2,4]triazolo[1,5-b]indazol-2-amine
SMILESCCNc1nn2nc3ccccc3c2n1-c1ccccc1
InChIInChI=1S/C16H15N5/c1-2-17-16-19-21-15(13-10-6-7-11-14(13)18-21)20(16)12-8-4-3-5-9-12/h3-11H,2H2,1H3,(H,17,19)
InChIKeyNNUAQERFPHWXJC-UHFFFAOYSA-N
XLogP3.11
TPSA47.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.33
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-phenyl-[1,2,4]triazolo[1,5-b]indazol-2-amine?
The IUPAC name of N-ethyl-1-phenyl-[1,2,4]triazolo[1,5-b]indazol-2-amine (CID 14639449) is N-ethyl-1-phenyl-[1,2,4]triazolo[1,5-b]indazol-2-amine.
What is the SMILES notation for N-ethyl-1-phenyl-[1,2,4]triazolo[1,5-b]indazol-2-amine?
The canonical SMILES for N-ethyl-1-phenyl-[1,2,4]triazolo[1,5-b]indazol-2-amine is CCNc1nn2nc3ccccc3c2n1-c1ccccc1.
What is the InChIKey of N-ethyl-1-phenyl-[1,2,4]triazolo[1,5-b]indazol-2-amine?
The InChIKey is NNUAQERFPHWXJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N5/c1-2-17-16-19-21-15(13-10-6-7-11-14(13)18-21)20(16)12-8-4-3-5-9-12/h3-11H,2H2,1H3,(H,17,19).
What are the key properties of N-ethyl-1-phenyl-[1,2,4]triazolo[1,5-b]indazol-2-amine?
N-ethyl-1-phenyl-[1,2,4]triazolo[1,5-b]indazol-2-amine has a molecular weight of 277.33 g/mol, XLogP of 3.11, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-phenyl-[1,2,4]triazolo[1,5-b]indazol-2-amine is sourced from PubChem (CID 14639449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).