N-(1-naphthalen-1-ylsulfonylindazol-5-yl)piperidine-4-carboxamide

C23H22N4O3S — CID 24771070

IUPACN-(1-naphthalen-1-ylsulfonylindazol-5-yl)piperidine-4-carboxamide
SMILESO=C(Nc1ccc2c(cnn2S(=O)(=O)c2cccc3ccccc23)c1)C1CCNCC1
InChIInChI=1S/C23H22N4O3S/c28-23(17-10-12-24-13-11-17)26-19-8-9-21-18(14-19)15-25-27(21)31(29,30)22-7-3-5-16-4-1-2-6-20(16)22/h1-9,14-15,17,24H,10-13H2,(H,26,28)
InChIKeyKDUGUOSWHLXZFI-UHFFFAOYSA-N
MW434.52 g/mol
LogP3.36
Rot. Bonds4

About N-(1-naphthalen-1-ylsulfonylindazol-5-yl)piperidine-4-carboxamide

N-(1-naphthalen-1-ylsulfonylindazol-5-yl)piperidine-4-carboxamide (PubChem CID 24771070) has the molecular formula C23H22N4O3S and a molecular weight of 434.52 g/mol. Its IUPAC name is N-(1-naphthalen-1-ylsulfonylindazol-5-yl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-(1-naphthalen-1-ylsulfonylindazol-5-yl)piperidine-4-carboxamide
PubChem CID24771070
Molecular FormulaC23H22N4O3S
Molecular Weight434.52 g/mol
Exact Mass434.14
IUPAC NameN-(1-naphthalen-1-ylsulfonylindazol-5-yl)piperidine-4-carboxamide
SMILESO=C(Nc1ccc2c(cnn2S(=O)(=O)c2cccc3ccccc23)c1)C1CCNCC1
InChIInChI=1S/C23H22N4O3S/c28-23(17-10-12-24-13-11-17)26-19-8-9-21-18(14-19)15-25-27(21)31(29,30)22-7-3-5-16-4-1-2-6-20(16)22/h1-9,14-15,17,24H,10-13H2,(H,26,28)
InChIKeyKDUGUOSWHLXZFI-UHFFFAOYSA-N
XLogP3.36
TPSA93.09 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500434.52
LogP ≤ 53.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(1-naphthalen-1-ylsulfonylindazol-6-yl)-3-piperidin-1-ylpropanamide
CID 24771124
N-naphthalen-1-ylpiperidine-4-carboxamide
CID 18073022
tert-butyl 5-[[2-[3-(piperidine-4-carbonylamino)phenyl]quinazolin-4-yl]amino]indazole-1-carboxylate
CID 59361889
N-[3-(propanoylamino)phenyl]piperidine-4-carboxamide
CID 54794417
tert-butyl 4-[(3-naphthalen-1-ylsulfonyl-2,3-dihydro-1H-indazol-5-yl)carbamoyl]piperidine-1-carboxylate
CID 143426590
N-[3-[(2-phenoxyacetyl)amino]phenyl]piperidine-4-carboxamide
CID 54794430
3-[methyl-(1-naphthalen-1-ylsulfonylindazol-6-yl)amino]propanamide
CID 24770955
N-(6-bromo-3-pyridinyl)piperidine-4-carboxamide
CID 103813896
N-[4-(propanoylamino)phenyl]piperidine-4-carboxamide
CID 43708676
(3S)-N-[3-methyl-4-(tetrazol-1-yl)phenyl]-1-naphthalen-1-ylsulfonylpiperidine-3-carboxamide
CID 1445961
1-naphthalen-1-ylsulfonylpiperazine
CID 42626101
N-naphthalen-2-yl-1-(naphthalen-1-ylmethyl)piperidine-3-carboxamide
CID 43919649

Frequently Asked Questions

What is the IUPAC name of N-(1-naphthalen-1-ylsulfonylindazol-5-yl)piperidine-4-carboxamide?
The IUPAC name of N-(1-naphthalen-1-ylsulfonylindazol-5-yl)piperidine-4-carboxamide (CID 24771070) is N-(1-naphthalen-1-ylsulfonylindazol-5-yl)piperidine-4-carboxamide.
What is the SMILES notation for N-(1-naphthalen-1-ylsulfonylindazol-5-yl)piperidine-4-carboxamide?
The canonical SMILES for N-(1-naphthalen-1-ylsulfonylindazol-5-yl)piperidine-4-carboxamide is O=C(Nc1ccc2c(cnn2S(=O)(=O)c2cccc3ccccc23)c1)C1CCNCC1.
What is the InChIKey of N-(1-naphthalen-1-ylsulfonylindazol-5-yl)piperidine-4-carboxamide?
The InChIKey is KDUGUOSWHLXZFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N4O3S/c28-23(17-10-12-24-13-11-17)26-19-8-9-21-18(14-19)15-25-27(21)31(29,30)22-7-3-5-16-4-1-2-6-20(16)22/h1-9,14-15,17,24H,10-13H2,(H,26,28).
What are the key properties of N-(1-naphthalen-1-ylsulfonylindazol-5-yl)piperidine-4-carboxamide?
N-(1-naphthalen-1-ylsulfonylindazol-5-yl)piperidine-4-carboxamide has a molecular weight of 434.52 g/mol, XLogP of 3.36, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-naphthalen-1-ylsulfonylindazol-5-yl)piperidine-4-carboxamide is sourced from PubChem (CID 24771070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).