4-[1-(4-fluorophenyl)indazol-3-yl]piperidine-1-carboxamide

C19H19FN4O — CID 14032641

IUPAC4-[1-(4-fluorophenyl)indazol-3-yl]piperidine-1-carboxamide
SMILESNC(=O)N1CCC(c2nn(-c3ccc(F)cc3)c3ccccc23)CC1
InChIInChI=1S/C19H19FN4O/c20-14-5-7-15(8-6-14)24-17-4-2-1-3-16(17)18(22-24)13-9-11-23(12-10-13)19(21)25/h1-8,13H,9-12H2,(H2,21,25)
InChIKeyXCXYXGLSCIVSQT-UHFFFAOYSA-N
MW338.39 g/mol
LogP3.42
Rot. Bonds2

About 4-[1-(4-fluorophenyl)indazol-3-yl]piperidine-1-carboxamide

4-[1-(4-fluorophenyl)indazol-3-yl]piperidine-1-carboxamide (PubChem CID 14032641) has the molecular formula C19H19FN4O and a molecular weight of 338.39 g/mol. Its IUPAC name is 4-[1-(4-fluorophenyl)indazol-3-yl]piperidine-1-carboxamide.

Molecular Properties

Compound Name4-[1-(4-fluorophenyl)indazol-3-yl]piperidine-1-carboxamide
PubChem CID14032641
Molecular FormulaC19H19FN4O
Molecular Weight338.39 g/mol
Exact Mass338.15
IUPAC Name4-[1-(4-fluorophenyl)indazol-3-yl]piperidine-1-carboxamide
SMILESNC(=O)N1CCC(c2nn(-c3ccc(F)cc3)c3ccccc23)CC1
InChIInChI=1S/C19H19FN4O/c20-14-5-7-15(8-6-14)24-17-4-2-1-3-16(17)18(22-24)13-9-11-23(12-10-13)19(21)25/h1-8,13H,9-12H2,(H2,21,25)
InChIKeyXCXYXGLSCIVSQT-UHFFFAOYSA-N
XLogP3.42
TPSA64.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.39
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[1-(2-carbamoylphenyl)indazol-3-yl]piperidine-1-carboxamide
CID 23048188
4-[1-(4-fluorophenyl)indazol-3-yl]piperazine-1-carboxylic acid
CID 19887075
(E)-but-2-enedioic acid;1-(4-chlorophenyl)-3-(1-methylpiperidin-4-yl)indazole
CID 14032529
1-[4-(6-methylsulfanyl-1-phenylindazol-3-yl)piperidin-1-yl]ethanone
CID 14032651
N-cyclopentyl-1-(4-fluorophenyl)-4-oxocinnoline-3-carboxamide
CID 53169768
but-2-enedioic acid;6-fluoro-1-(2-fluorophenyl)-3-(1-methylpiperidin-4-yl)indazole
CID 70358269
[1-(3-fluorophenyl)indazol-3-yl]-(4-methylpiperidin-1-yl)methanone
CID 50840809
N-[1-(1-carbamoylpiperidin-4-yl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide
CID 45137540
N-[(2S)-1-(4-carbamoylpiperazin-1-yl)-3,3-dimethyl-1-oxobutan-2-yl]-1-[(4-fluorophenyl)methyl]indazole-3-carboxamide
CID 58124698
2-[4-(3-cyclopropylindazol-1-yl)phenyl]-N-[(1R)-1-[5-(2,2,2-trifluoroethoxy)-2-pyridinyl]ethyl]acetamide
CID 42610137
5-fluoro-3-piperidin-4-yl-1-[4-(trifluoromethyl)phenyl]indazole;hydrochloride
CID 14032601
3-cyclopropyl-1-(4-fluorophenyl)-5-propylpyrazole-4-carboxylic acid
CID 42819806

Frequently Asked Questions

What is the IUPAC name of 4-[1-(4-fluorophenyl)indazol-3-yl]piperidine-1-carboxamide?
The IUPAC name of 4-[1-(4-fluorophenyl)indazol-3-yl]piperidine-1-carboxamide (CID 14032641) is 4-[1-(4-fluorophenyl)indazol-3-yl]piperidine-1-carboxamide.
What is the SMILES notation for 4-[1-(4-fluorophenyl)indazol-3-yl]piperidine-1-carboxamide?
The canonical SMILES for 4-[1-(4-fluorophenyl)indazol-3-yl]piperidine-1-carboxamide is NC(=O)N1CCC(c2nn(-c3ccc(F)cc3)c3ccccc23)CC1.
What is the InChIKey of 4-[1-(4-fluorophenyl)indazol-3-yl]piperidine-1-carboxamide?
The InChIKey is XCXYXGLSCIVSQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19FN4O/c20-14-5-7-15(8-6-14)24-17-4-2-1-3-16(17)18(22-24)13-9-11-23(12-10-13)19(21)25/h1-8,13H,9-12H2,(H2,21,25).
What are the key properties of 4-[1-(4-fluorophenyl)indazol-3-yl]piperidine-1-carboxamide?
4-[1-(4-fluorophenyl)indazol-3-yl]piperidine-1-carboxamide has a molecular weight of 338.39 g/mol, XLogP of 3.42, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(4-fluorophenyl)indazol-3-yl]piperidine-1-carboxamide is sourced from PubChem (CID 14032641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).