N-cyclohexyl-1-cyclopentyl-3-phenyl-N-propan-2-ylpyrazole-4-sulfonamide

C23H33N3O2S — CID 42346917

IUPACN-cyclohexyl-1-cyclopentyl-3-phenyl-N-propan-2-ylpyrazole-4-sulfonamide
SMILESCC(C)N(C1CCCCC1)S(=O)(=O)c1cn(C2CCCC2)nc1-c1ccccc1
InChIInChI=1S/C23H33N3O2S/c1-18(2)26(21-15-7-4-8-16-21)29(27,28)22-17-25(20-13-9-10-14-20)24-23(22)19-11-5-3-6-12-19/h3,5-6,11-12,17-18,20-21H,4,7-10,13-16H2,1-2H3
InChIKeyUZMONLXPHKDRRY-UHFFFAOYSA-N
MW415.60 g/mol
LogP5.40
Rot. Bonds6

About N-cyclohexyl-1-cyclopentyl-3-phenyl-N-propan-2-ylpyrazole-4-sulfonamide

N-cyclohexyl-1-cyclopentyl-3-phenyl-N-propan-2-ylpyrazole-4-sulfonamide (PubChem CID 42346917) has the molecular formula C23H33N3O2S and a molecular weight of 415.60 g/mol. Its IUPAC name is N-cyclohexyl-1-cyclopentyl-3-phenyl-N-propan-2-ylpyrazole-4-sulfonamide.

Molecular Properties

Compound NameN-cyclohexyl-1-cyclopentyl-3-phenyl-N-propan-2-ylpyrazole-4-sulfonamide
PubChem CID42346917
Molecular FormulaC23H33N3O2S
Molecular Weight415.60 g/mol
Exact Mass415.23
IUPAC NameN-cyclohexyl-1-cyclopentyl-3-phenyl-N-propan-2-ylpyrazole-4-sulfonamide
SMILESCC(C)N(C1CCCCC1)S(=O)(=O)c1cn(C2CCCC2)nc1-c1ccccc1
InChIInChI=1S/C23H33N3O2S/c1-18(2)26(21-15-7-4-8-16-21)29(27,28)22-17-25(20-13-9-10-14-20)24-23(22)19-11-5-3-6-12-19/h3,5-6,11-12,17-18,20-21H,4,7-10,13-16H2,1-2H3
InChIKeyUZMONLXPHKDRRY-UHFFFAOYSA-N
XLogP5.40
TPSA55.20 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500415.60
LogP ≤ 55.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-cyclopentyl-3-phenyl-N,N-dipropylpyrazole-4-sulfonamide
CID 42346854
3-tert-butyl-N-cyclohexyl-1-cyclopentyl-N-propan-2-ylpyrazole-4-sulfonamide
CID 42284010
N-benzyl-1-cyclopentyl-N-ethyl-3-phenylpyrazole-4-sulfonamide
CID 42346901
1-cyclopentyl-N,N-bis(2-methoxyethyl)-3-phenylpyrazole-4-sulfonamide
CID 42346872
1-cyclopentyl-N-methyl-3-phenylpyrazole-4-sulfonamide
CID 42347151
N-benzyl-1-cyclopentyl-3-phenylpyrazole-4-sulfonamide
CID 42347371
1-(1-cyclopentyl-3-phenylpyrazol-4-yl)sulfonyl-4-ethylpiperazine
CID 42347063
1-cyclopentyl-N,N-bis(2-methylpropyl)-3-thiophen-2-ylpyrazole-4-sulfonamide
CID 42350593
N-cyclohexyl-N-(2-hydroxyethyl)-1,3-diphenylpyrazole-4-sulfonamide
CID 42349121
1-cyclopentyl-N-(4-methyl-1,3-thiazol-2-yl)-3-phenylpyrazole-4-sulfonamide
CID 42285010
N-(4-bromo-2-methylphenyl)-1-cyclopentyl-3-phenylpyrazole-4-sulfonamide
CID 42285003
methyl 4-[(1-cyclopentyl-3-phenylpyrazol-4-yl)sulfonylamino]benzoate
CID 42284988

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-1-cyclopentyl-3-phenyl-N-propan-2-ylpyrazole-4-sulfonamide?
The IUPAC name of N-cyclohexyl-1-cyclopentyl-3-phenyl-N-propan-2-ylpyrazole-4-sulfonamide (CID 42346917) is N-cyclohexyl-1-cyclopentyl-3-phenyl-N-propan-2-ylpyrazole-4-sulfonamide.
What is the SMILES notation for N-cyclohexyl-1-cyclopentyl-3-phenyl-N-propan-2-ylpyrazole-4-sulfonamide?
The canonical SMILES for N-cyclohexyl-1-cyclopentyl-3-phenyl-N-propan-2-ylpyrazole-4-sulfonamide is CC(C)N(C1CCCCC1)S(=O)(=O)c1cn(C2CCCC2)nc1-c1ccccc1.
What is the InChIKey of N-cyclohexyl-1-cyclopentyl-3-phenyl-N-propan-2-ylpyrazole-4-sulfonamide?
The InChIKey is UZMONLXPHKDRRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H33N3O2S/c1-18(2)26(21-15-7-4-8-16-21)29(27,28)22-17-25(20-13-9-10-14-20)24-23(22)19-11-5-3-6-12-19/h3,5-6,11-12,17-18,20-21H,4,7-10,13-16H2,1-2H3.
What are the key properties of N-cyclohexyl-1-cyclopentyl-3-phenyl-N-propan-2-ylpyrazole-4-sulfonamide?
N-cyclohexyl-1-cyclopentyl-3-phenyl-N-propan-2-ylpyrazole-4-sulfonamide has a molecular weight of 415.60 g/mol, XLogP of 5.40, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-1-cyclopentyl-3-phenyl-N-propan-2-ylpyrazole-4-sulfonamide is sourced from PubChem (CID 42346917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).