N-[1-(2,4-difluorophenyl)ethyl]-1H-indazol-6-amine

C15H13F2N3 — CID 43743449

IUPACN-[1-(2,4-difluorophenyl)ethyl]-1H-indazol-6-amine
SMILESCC(Nc1ccc2cn[nH]c2c1)c1ccc(F)cc1F
InChIInChI=1S/C15H13F2N3/c1-9(13-5-3-11(16)6-14(13)17)19-12-4-2-10-8-18-20-15(10)7-12/h2-9,19H,1H3,(H,18,20)
InChIKeyDGQORWFFCZMHFM-UHFFFAOYSA-N
MW273.29 g/mol
LogP4.01
Rot. Bonds3

About N-[1-(2,4-difluorophenyl)ethyl]-1H-indazol-6-amine

N-[1-(2,4-difluorophenyl)ethyl]-1H-indazol-6-amine (PubChem CID 43743449) has the molecular formula C15H13F2N3 and a molecular weight of 273.29 g/mol. Its IUPAC name is N-[1-(2,4-difluorophenyl)ethyl]-1H-indazol-6-amine.

Molecular Properties

Compound NameN-[1-(2,4-difluorophenyl)ethyl]-1H-indazol-6-amine
PubChem CID43743449
Molecular FormulaC15H13F2N3
Molecular Weight273.29 g/mol
Exact Mass273.11
IUPAC NameN-[1-(2,4-difluorophenyl)ethyl]-1H-indazol-6-amine
SMILESCC(Nc1ccc2cn[nH]c2c1)c1ccc(F)cc1F
InChIInChI=1S/C15H13F2N3/c1-9(13-5-3-11(16)6-14(13)17)19-12-4-2-10-8-18-20-15(10)7-12/h2-9,19H,1H3,(H,18,20)
InChIKeyDGQORWFFCZMHFM-UHFFFAOYSA-N
XLogP4.01
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.29
LogP ≤ 54.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(2,4-difluorophenyl)ethyl]-4-fluoroaniline
CID 43194675
N-[1-(4-bromothiophen-2-yl)ethyl]-1H-indazol-6-amine
CID 107354219
N-[1-(5-chlorothiophen-2-yl)ethyl]-1H-indazol-6-amine
CID 43743466
N-[1-(3-fluorophenyl)ethyl]-1H-indazol-5-amine
CID 43691008
N-(5-methylheptan-3-yl)-1H-indazol-6-amine
CID 43743481
5-[1-(2,4-difluorophenyl)ethylamino]-2-methylphenol
CID 107700745
N-[1-(2,4-difluorophenyl)ethyl]-2,5-difluoroaniline
CID 43192585
N-[1-(1-methylcyclopropyl)ethyl]-1H-indazol-6-amine
CID 43743475
N-[1-(5-fluoro-3-pyridinyl)ethyl]-1H-indazol-5-amine
CID 103932201
4-butan-2-yl-N-[1-(2,4-difluorophenyl)ethyl]aniline
CID 43681088
N-[1-(3-bromo-4-methoxyphenyl)ethyl]-1H-indazol-6-amine
CID 43790611
2-chloro-5-[1-(2,4-difluorophenyl)ethylamino]benzonitrile
CID 43686866

Frequently Asked Questions

What is the IUPAC name of N-[1-(2,4-difluorophenyl)ethyl]-1H-indazol-6-amine?
The IUPAC name of N-[1-(2,4-difluorophenyl)ethyl]-1H-indazol-6-amine (CID 43743449) is N-[1-(2,4-difluorophenyl)ethyl]-1H-indazol-6-amine.
What is the SMILES notation for N-[1-(2,4-difluorophenyl)ethyl]-1H-indazol-6-amine?
The canonical SMILES for N-[1-(2,4-difluorophenyl)ethyl]-1H-indazol-6-amine is CC(Nc1ccc2cn[nH]c2c1)c1ccc(F)cc1F.
What is the InChIKey of N-[1-(2,4-difluorophenyl)ethyl]-1H-indazol-6-amine?
The InChIKey is DGQORWFFCZMHFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F2N3/c1-9(13-5-3-11(16)6-14(13)17)19-12-4-2-10-8-18-20-15(10)7-12/h2-9,19H,1H3,(H,18,20).
What are the key properties of N-[1-(2,4-difluorophenyl)ethyl]-1H-indazol-6-amine?
N-[1-(2,4-difluorophenyl)ethyl]-1H-indazol-6-amine has a molecular weight of 273.29 g/mol, XLogP of 4.01, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2,4-difluorophenyl)ethyl]-1H-indazol-6-amine is sourced from PubChem (CID 43743449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).