3-(4-fluorophenyl)-N-(1H-indazol-6-yl)propanamide

C16H14FN3O — CID 36561610

IUPAC3-(4-fluorophenyl)-N-(1H-indazol-6-yl)propanamide
SMILESO=C(CCc1ccc(F)cc1)Nc1ccc2cn[nH]c2c1
InChIInChI=1S/C16H14FN3O/c17-13-5-1-11(2-6-13)3-8-16(21)19-14-7-4-12-10-18-20-15(12)9-14/h1-2,4-7,9-10H,3,8H2,(H,18,20)(H,19,21)
InChIKeyLOFHXRZRSBBBEA-UHFFFAOYSA-N
MW283.31 g/mol
LogP3.27
Rot. Bonds4

About 3-(4-fluorophenyl)-N-(1H-indazol-6-yl)propanamide

3-(4-fluorophenyl)-N-(1H-indazol-6-yl)propanamide (PubChem CID 36561610) has the molecular formula C16H14FN3O and a molecular weight of 283.31 g/mol. Its IUPAC name is 3-(4-fluorophenyl)-N-(1H-indazol-6-yl)propanamide.

Molecular Properties

Compound Name3-(4-fluorophenyl)-N-(1H-indazol-6-yl)propanamide
PubChem CID36561610
Molecular FormulaC16H14FN3O
Molecular Weight283.31 g/mol
Exact Mass283.11
IUPAC Name3-(4-fluorophenyl)-N-(1H-indazol-6-yl)propanamide
SMILESO=C(CCc1ccc(F)cc1)Nc1ccc2cn[nH]c2c1
InChIInChI=1S/C16H14FN3O/c17-13-5-1-11(2-6-13)3-8-16(21)19-14-7-4-12-10-18-20-15(12)9-14/h1-2,4-7,9-10H,3,8H2,(H,18,20)(H,19,21)
InChIKeyLOFHXRZRSBBBEA-UHFFFAOYSA-N
XLogP3.27
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.31
LogP ≤ 53.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1H-indazol-6-yl)-3-(4-methylphenyl)propanamide
CID 36563064
2-(3-fluorophenyl)-N-(1H-indazol-6-yl)acetamide
CID 36559456
3-(4-fluorophenyl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide
CID 18160949
N-(1H-indazol-6-yl)-3-(2-methylphenyl)propanamide
CID 110731205
3-(5-bromothiophen-2-yl)-N-(1H-indazol-6-yl)propanamide
CID 166365205
2-(4-aminophenyl)-N-(1H-indazol-6-yl)acetamide
CID 43710788
3-(4-bromothiophen-2-yl)-N-(1H-indazol-6-yl)propanamide
CID 166179582
5-amino-N-(1H-indazol-6-yl)-4-methylpentanamide
CID 82012714
N-(1H-indazol-6-yl)-2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide
CID 110772201
3-(4-fluorophenyl)-N-pyridin-4-ylpropanamide
CID 30157880
N-(1H-indazol-6-yl)-3-isoquinolin-5-ylpropanamide
CID 155966917
3-(3-tert-butyl-1,2,4-oxadiazol-5-yl)-N-(1H-indazol-6-yl)propanamide
CID 47030832

Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenyl)-N-(1H-indazol-6-yl)propanamide?
The IUPAC name of 3-(4-fluorophenyl)-N-(1H-indazol-6-yl)propanamide (CID 36561610) is 3-(4-fluorophenyl)-N-(1H-indazol-6-yl)propanamide.
What is the SMILES notation for 3-(4-fluorophenyl)-N-(1H-indazol-6-yl)propanamide?
The canonical SMILES for 3-(4-fluorophenyl)-N-(1H-indazol-6-yl)propanamide is O=C(CCc1ccc(F)cc1)Nc1ccc2cn[nH]c2c1.
What is the InChIKey of 3-(4-fluorophenyl)-N-(1H-indazol-6-yl)propanamide?
The InChIKey is LOFHXRZRSBBBEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14FN3O/c17-13-5-1-11(2-6-13)3-8-16(21)19-14-7-4-12-10-18-20-15(12)9-14/h1-2,4-7,9-10H,3,8H2,(H,18,20)(H,19,21).
What are the key properties of 3-(4-fluorophenyl)-N-(1H-indazol-6-yl)propanamide?
3-(4-fluorophenyl)-N-(1H-indazol-6-yl)propanamide has a molecular weight of 283.31 g/mol, XLogP of 3.27, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)-N-(1H-indazol-6-yl)propanamide is sourced from PubChem (CID 36561610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).