N-(1-naphthalen-1-ylsulfonylindazol-6-yl)-3-piperidin-1-ylpropanamide

C25H26N4O3S — CID 24771124

IUPACN-(1-naphthalen-1-ylsulfonylindazol-6-yl)-3-piperidin-1-ylpropanamide
SMILESO=C(CCN1CCCCC1)Nc1ccc2cnn(S(=O)(=O)c3cccc4ccccc34)c2c1
InChIInChI=1S/C25H26N4O3S/c30-25(13-16-28-14-4-1-5-15-28)27-21-12-11-20-18-26-29(23(20)17-21)33(31,32)24-10-6-8-19-7-2-3-9-22(19)24/h2-3,6-12,17-18H,1,4-5,13-16H2,(H,27,30)
InChIKeyFFIRYORFNXDFMX-UHFFFAOYSA-N
MW462.58 g/mol
LogP4.24
Rot. Bonds6

About N-(1-naphthalen-1-ylsulfonylindazol-6-yl)-3-piperidin-1-ylpropanamide

N-(1-naphthalen-1-ylsulfonylindazol-6-yl)-3-piperidin-1-ylpropanamide (PubChem CID 24771124) has the molecular formula C25H26N4O3S and a molecular weight of 462.58 g/mol. Its IUPAC name is N-(1-naphthalen-1-ylsulfonylindazol-6-yl)-3-piperidin-1-ylpropanamide.

Molecular Properties

Compound NameN-(1-naphthalen-1-ylsulfonylindazol-6-yl)-3-piperidin-1-ylpropanamide
PubChem CID24771124
Molecular FormulaC25H26N4O3S
Molecular Weight462.58 g/mol
Exact Mass462.17
IUPAC NameN-(1-naphthalen-1-ylsulfonylindazol-6-yl)-3-piperidin-1-ylpropanamide
SMILESO=C(CCN1CCCCC1)Nc1ccc2cnn(S(=O)(=O)c3cccc4ccccc34)c2c1
InChIInChI=1S/C25H26N4O3S/c30-25(13-16-28-14-4-1-5-15-28)27-21-12-11-20-18-26-29(23(20)17-21)33(31,32)24-10-6-8-19-7-2-3-9-22(19)24/h2-3,6-12,17-18H,1,4-5,13-16H2,(H,27,30)
InChIKeyFFIRYORFNXDFMX-UHFFFAOYSA-N
XLogP4.24
TPSA84.30 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500462.58
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(3-naphthalen-1-ylsulfonyl-2H-indazol-6-yl)-3-piperidin-1-ylpropanamide
CID 53323436
N-(3-naphthalen-1-ylsulfonyl-2H-indazol-6-yl)-3-piperidin-1-ylpropanamide;hydrochloride
CID 53323435
N-(1-naphthalen-1-ylsulfonylindazol-5-yl)piperidine-4-carboxamide
CID 24771070
N-(3,4-dimethylphenyl)-3-piperidin-1-ylpropanamide
CID 771569
(3-amino-3-oxopropyl)-dimethyl-(1-naphthalen-1-ylsulfonylindazol-6-yl)azanium
CID 24771240
3-[methyl-(1-naphthalen-1-ylsulfonylindazol-6-yl)amino]propanamide
CID 24770955
3-[3-(azepan-1-yl)propanoylamino]benzoic acid
CID 53215946
N-[1-(benzenesulfonyl)indazol-6-yl]acetamide
CID 156879676
ethane;N-(3-methylphenyl)-3-piperidin-1-ylpropanamide
CID 143383579
N-(3-chlorophenyl)-3-piperidin-1-ylpropanamide chloride
CID 53313683
N-[9-methyl-6-(3-pyrrolidin-1-ylpropanoylamino)acridin-3-yl]-3-pyrrolidin-1-ylpropanamide
CID 59868948
N-[1-(2-pyrrolidin-1-ylethyl)indol-6-yl]naphthalene-1-sulfonamide
CID 11362134

Frequently Asked Questions

What is the IUPAC name of N-(1-naphthalen-1-ylsulfonylindazol-6-yl)-3-piperidin-1-ylpropanamide?
The IUPAC name of N-(1-naphthalen-1-ylsulfonylindazol-6-yl)-3-piperidin-1-ylpropanamide (CID 24771124) is N-(1-naphthalen-1-ylsulfonylindazol-6-yl)-3-piperidin-1-ylpropanamide.
What is the SMILES notation for N-(1-naphthalen-1-ylsulfonylindazol-6-yl)-3-piperidin-1-ylpropanamide?
The canonical SMILES for N-(1-naphthalen-1-ylsulfonylindazol-6-yl)-3-piperidin-1-ylpropanamide is O=C(CCN1CCCCC1)Nc1ccc2cnn(S(=O)(=O)c3cccc4ccccc34)c2c1.
What is the InChIKey of N-(1-naphthalen-1-ylsulfonylindazol-6-yl)-3-piperidin-1-ylpropanamide?
The InChIKey is FFIRYORFNXDFMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N4O3S/c30-25(13-16-28-14-4-1-5-15-28)27-21-12-11-20-18-26-29(23(20)17-21)33(31,32)24-10-6-8-19-7-2-3-9-22(19)24/h2-3,6-12,17-18H,1,4-5,13-16H2,(H,27,30).
What are the key properties of N-(1-naphthalen-1-ylsulfonylindazol-6-yl)-3-piperidin-1-ylpropanamide?
N-(1-naphthalen-1-ylsulfonylindazol-6-yl)-3-piperidin-1-ylpropanamide has a molecular weight of 462.58 g/mol, XLogP of 4.24, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-naphthalen-1-ylsulfonylindazol-6-yl)-3-piperidin-1-ylpropanamide is sourced from PubChem (CID 24771124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).