6-fluoro-N-[(4-fluorophenyl)methyl]-1H-indazol-3-amine

C14H11F2N3 — CID 164610577

IUPAC6-fluoro-N-[(4-fluorophenyl)methyl]-1H-indazol-3-amine
SMILESFc1ccc(CNc2n[nH]c3cc(F)ccc23)cc1
InChIInChI=1S/C14H11F2N3/c15-10-3-1-9(2-4-10)8-17-14-12-6-5-11(16)7-13(12)18-19-14/h1-7H,8H2,(H2,17,18,19)
InChIKeyLZVFCHQMDMABHE-UHFFFAOYSA-N
MW259.26 g/mol
LogP3.45
Rot. Bonds3

About 6-fluoro-N-[(4-fluorophenyl)methyl]-1H-indazol-3-amine

6-fluoro-N-[(4-fluorophenyl)methyl]-1H-indazol-3-amine (PubChem CID 164610577) has the molecular formula C14H11F2N3 and a molecular weight of 259.26 g/mol. Its IUPAC name is 6-fluoro-N-[(4-fluorophenyl)methyl]-1H-indazol-3-amine.

Molecular Properties

Compound Name6-fluoro-N-[(4-fluorophenyl)methyl]-1H-indazol-3-amine
PubChem CID164610577
Molecular FormulaC14H11F2N3
Molecular Weight259.26 g/mol
Exact Mass259.09
IUPAC Name6-fluoro-N-[(4-fluorophenyl)methyl]-1H-indazol-3-amine
SMILESFc1ccc(CNc2n[nH]c3cc(F)ccc23)cc1
InChIInChI=1S/C14H11F2N3/c15-10-3-1-9(2-4-10)8-17-14-12-6-5-11(16)7-13(12)18-19-14/h1-7H,8H2,(H2,17,18,19)
InChIKeyLZVFCHQMDMABHE-UHFFFAOYSA-N
XLogP3.45
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.26
LogP ≤ 53.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

CID 817911
CID 817911
CID 11776377
CID 11776377
CID 25096268
CID 25096268
CID 25096270
CID 25096270
CID 25096271
CID 25096271
CID 25197520
CID 25197520
CID 44405477
CID 44405477
CID 46889747
CID 46889747
CID 50994257
CID 50994257
CID 51361059
CID 51361059
CID 53320513
CID 53320513
CID 53322685
CID 53322685

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-N-[(4-fluorophenyl)methyl]-1H-indazol-3-amine?
The IUPAC name of 6-fluoro-N-[(4-fluorophenyl)methyl]-1H-indazol-3-amine (CID 164610577) is 6-fluoro-N-[(4-fluorophenyl)methyl]-1H-indazol-3-amine.
What is the SMILES notation for 6-fluoro-N-[(4-fluorophenyl)methyl]-1H-indazol-3-amine?
The canonical SMILES for 6-fluoro-N-[(4-fluorophenyl)methyl]-1H-indazol-3-amine is Fc1ccc(CNc2n[nH]c3cc(F)ccc23)cc1.
What is the InChIKey of 6-fluoro-N-[(4-fluorophenyl)methyl]-1H-indazol-3-amine?
The InChIKey is LZVFCHQMDMABHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11F2N3/c15-10-3-1-9(2-4-10)8-17-14-12-6-5-11(16)7-13(12)18-19-14/h1-7H,8H2,(H2,17,18,19).
What are the key properties of 6-fluoro-N-[(4-fluorophenyl)methyl]-1H-indazol-3-amine?
6-fluoro-N-[(4-fluorophenyl)methyl]-1H-indazol-3-amine has a molecular weight of 259.26 g/mol, XLogP of 3.45, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-N-[(4-fluorophenyl)methyl]-1H-indazol-3-amine is sourced from PubChem (CID 164610577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).