N-[6-(3-fluorophenyl)-1H-indazol-3-yl]-2-phenoxypropanamide

C22H18FN3O2 — CID 69061525

IUPACN-[6-(3-fluorophenyl)-1H-indazol-3-yl]-2-phenoxypropanamide
SMILESCC(Oc1ccccc1)C(=O)Nc1n[nH]c2cc(-c3cccc(F)c3)ccc12
InChIInChI=1S/C22H18FN3O2/c1-14(28-18-8-3-2-4-9-18)22(27)24-21-19-11-10-16(13-20(19)25-26-21)15-6-5-7-17(23)12-15/h2-14H,1H3,(H2,24,25,26,27)
InChIKeyOIDWQQATXVVHTG-UHFFFAOYSA-N
MW375.40 g/mol
LogP4.78
Rot. Bonds5

About N-[6-(3-fluorophenyl)-1H-indazol-3-yl]-2-phenoxypropanamide

N-[6-(3-fluorophenyl)-1H-indazol-3-yl]-2-phenoxypropanamide (PubChem CID 69061525) has the molecular formula C22H18FN3O2 and a molecular weight of 375.40 g/mol. Its IUPAC name is N-[6-(3-fluorophenyl)-1H-indazol-3-yl]-2-phenoxypropanamide.

Molecular Properties

Compound NameN-[6-(3-fluorophenyl)-1H-indazol-3-yl]-2-phenoxypropanamide
PubChem CID69061525
Molecular FormulaC22H18FN3O2
Molecular Weight375.40 g/mol
Exact Mass375.14
IUPAC NameN-[6-(3-fluorophenyl)-1H-indazol-3-yl]-2-phenoxypropanamide
SMILESCC(Oc1ccccc1)C(=O)Nc1n[nH]c2cc(-c3cccc(F)c3)ccc12
InChIInChI=1S/C22H18FN3O2/c1-14(28-18-8-3-2-4-9-18)22(27)24-21-19-11-10-16(13-20(19)25-26-21)15-6-5-7-17(23)12-15/h2-14H,1H3,(H2,24,25,26,27)
InChIKeyOIDWQQATXVVHTG-UHFFFAOYSA-N
XLogP4.78
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.40
LogP ≤ 54.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]-2-phenoxypropanamide
CID 69070154
N-[6-(3-fluorophenyl)-1H-indazol-3-yl]-2,4-dimethoxybenzamide
CID 69063264
N-[6-(3-acetylphenyl)-1H-indazol-3-yl]-3-fluorobenzamide
CID 69067364
2-[3-(3-fluorophenyl)phenoxy]propanoic acid
CID 82044897
2-(4-fluorophenoxy)-N-(3-phenyl-1,2-oxazol-5-yl)propanamide
CID 17013988
(2S)-2-(3-fluorophenoxy)-N-(2-phenoxyethyl)propanamide
CID 30865784
2-phenoxy-N-[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]propanamide
CID 22479879
[2-[[6-(2,6-dimethylphenyl)-1H-indazol-3-yl]amino]-2-oxo-1-phenylethyl] acetate
CID 69059417
N-[6-[3-(cyclopropylsulfonylamino)phenyl]-1H-indazol-3-yl]-2-methylpropanamide
CID 146121078
N-(3-fluorophenyl)-2-(4-methylphenoxy)propanamide
CID 18076804
N-(2-ethylphenyl)-2-(3-fluorophenoxy)propanamide
CID 86918484
1-[6-(4-methoxyphenyl)-1H-indazol-3-yl]-3-propan-2-ylurea
CID 69070012

Frequently Asked Questions

What is the IUPAC name of N-[6-(3-fluorophenyl)-1H-indazol-3-yl]-2-phenoxypropanamide?
The IUPAC name of N-[6-(3-fluorophenyl)-1H-indazol-3-yl]-2-phenoxypropanamide (CID 69061525) is N-[6-(3-fluorophenyl)-1H-indazol-3-yl]-2-phenoxypropanamide.
What is the SMILES notation for N-[6-(3-fluorophenyl)-1H-indazol-3-yl]-2-phenoxypropanamide?
The canonical SMILES for N-[6-(3-fluorophenyl)-1H-indazol-3-yl]-2-phenoxypropanamide is CC(Oc1ccccc1)C(=O)Nc1n[nH]c2cc(-c3cccc(F)c3)ccc12.
What is the InChIKey of N-[6-(3-fluorophenyl)-1H-indazol-3-yl]-2-phenoxypropanamide?
The InChIKey is OIDWQQATXVVHTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18FN3O2/c1-14(28-18-8-3-2-4-9-18)22(27)24-21-19-11-10-16(13-20(19)25-26-21)15-6-5-7-17(23)12-15/h2-14H,1H3,(H2,24,25,26,27).
What are the key properties of N-[6-(3-fluorophenyl)-1H-indazol-3-yl]-2-phenoxypropanamide?
N-[6-(3-fluorophenyl)-1H-indazol-3-yl]-2-phenoxypropanamide has a molecular weight of 375.40 g/mol, XLogP of 4.78, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(3-fluorophenyl)-1H-indazol-3-yl]-2-phenoxypropanamide is sourced from PubChem (CID 69061525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).