N-propan-2-yl-4-(quinolin-8-ylsulfonylamino)-1H-pyrazole-5-carboxamide

C16H17N5O3S — CID 69380952

IUPACN-propan-2-yl-4-(quinolin-8-ylsulfonylamino)-1H-pyrazole-5-carboxamide
SMILESCC(C)NC(=O)c1[nH]ncc1NS(=O)(=O)c1cccc2cccnc12
InChIInChI=1S/C16H17N5O3S/c1-10(2)19-16(22)15-12(9-18-20-15)21-25(23,24)13-7-3-5-11-6-4-8-17-14(11)13/h3-10,21H,1-2H3,(H,18,20)(H,19,22)
InChIKeyLPRDPFFFINYZNK-UHFFFAOYSA-N
MW359.41 g/mol
LogP1.90
Rot. Bonds5

About N-propan-2-yl-4-(quinolin-8-ylsulfonylamino)-1H-pyrazole-5-carboxamide

N-propan-2-yl-4-(quinolin-8-ylsulfonylamino)-1H-pyrazole-5-carboxamide (PubChem CID 69380952) has the molecular formula C16H17N5O3S and a molecular weight of 359.41 g/mol. Its IUPAC name is N-propan-2-yl-4-(quinolin-8-ylsulfonylamino)-1H-pyrazole-5-carboxamide.

Molecular Properties

Compound NameN-propan-2-yl-4-(quinolin-8-ylsulfonylamino)-1H-pyrazole-5-carboxamide
PubChem CID69380952
Molecular FormulaC16H17N5O3S
Molecular Weight359.41 g/mol
Exact Mass359.11
IUPAC NameN-propan-2-yl-4-(quinolin-8-ylsulfonylamino)-1H-pyrazole-5-carboxamide
SMILESCC(C)NC(=O)c1[nH]ncc1NS(=O)(=O)c1cccc2cccnc12
InChIInChI=1S/C16H17N5O3S/c1-10(2)19-16(22)15-12(9-18-20-15)21-25(23,24)13-7-3-5-11-6-4-8-17-14(11)13/h3-10,21H,1-2H3,(H,18,20)(H,19,22)
InChIKeyLPRDPFFFINYZNK-UHFFFAOYSA-N
XLogP1.90
TPSA116.84 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.41
LogP ≤ 51.90
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

4-[(2,5-dichlorophenyl)sulfonylamino]-N-propan-2-yl-1H-pyrazole-5-carboxamide
CID 69379969
N-(2,3-dimethoxyphenyl)quinoline-8-sulfonamide
CID 3866922
N-[2,6-di(propan-2-yl)phenyl]quinoline-8-sulfonamide
CID 19683991
N-(2,5-difluorophenyl)quinoline-8-sulfonamide
CID 22773481
N-cyclohexyl-2-(quinolin-8-ylsulfonylamino)benzamide
CID 7573778
N-[1-(4-methylphenyl)propyl]-2-(quinolin-8-ylsulfonylamino)benzamide
CID 20796159
dimethyl 2-(quinolin-8-ylsulfonylamino)benzene-1,4-dicarboxylate
CID 4198827
N-[4-(quinolin-8-ylsulfonylamino)phenyl]acetamide
CID 2443922
N-(2,4-dimethylphenyl)quinoline-8-sulfonamide
CID 4067742
N-(2,6-dichlorophenyl)quinoline-8-sulfonamide
CID 5068800
3-(quinolin-8-ylsulfonylamino)-1H-indole-2-carboxylic acid
CID 91569703
2-hydroxy-N-quinolin-8-ylbenzenesulfonamide
CID 1380884

Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-4-(quinolin-8-ylsulfonylamino)-1H-pyrazole-5-carboxamide?
The IUPAC name of N-propan-2-yl-4-(quinolin-8-ylsulfonylamino)-1H-pyrazole-5-carboxamide (CID 69380952) is N-propan-2-yl-4-(quinolin-8-ylsulfonylamino)-1H-pyrazole-5-carboxamide.
What is the SMILES notation for N-propan-2-yl-4-(quinolin-8-ylsulfonylamino)-1H-pyrazole-5-carboxamide?
The canonical SMILES for N-propan-2-yl-4-(quinolin-8-ylsulfonylamino)-1H-pyrazole-5-carboxamide is CC(C)NC(=O)c1[nH]ncc1NS(=O)(=O)c1cccc2cccnc12.
What is the InChIKey of N-propan-2-yl-4-(quinolin-8-ylsulfonylamino)-1H-pyrazole-5-carboxamide?
The InChIKey is LPRDPFFFINYZNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N5O3S/c1-10(2)19-16(22)15-12(9-18-20-15)21-25(23,24)13-7-3-5-11-6-4-8-17-14(11)13/h3-10,21H,1-2H3,(H,18,20)(H,19,22).
What are the key properties of N-propan-2-yl-4-(quinolin-8-ylsulfonylamino)-1H-pyrazole-5-carboxamide?
N-propan-2-yl-4-(quinolin-8-ylsulfonylamino)-1H-pyrazole-5-carboxamide has a molecular weight of 359.41 g/mol, XLogP of 1.90, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-4-(quinolin-8-ylsulfonylamino)-1H-pyrazole-5-carboxamide is sourced from PubChem (CID 69380952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).