N-[4-[(2-pyrazol-1-yl-3-pyridinyl)methylsulfamoyl]phenyl]acetamide

C17H17N5O3S — CID 55663375

IUPACN-[4-[(2-pyrazol-1-yl-3-pyridinyl)methylsulfamoyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)NCc2cccnc2-n2cccn2)cc1
InChIInChI=1S/C17H17N5O3S/c1-13(23)21-15-5-7-16(8-6-15)26(24,25)20-12-14-4-2-9-18-17(14)22-11-3-10-19-22/h2-11,20H,12H2,1H3,(H,21,23)
InChIKeyCPKMRBKTDCXYEW-UHFFFAOYSA-N
MW371.42 g/mol
LogP1.70
Rot. Bonds6

About N-[4-[(2-pyrazol-1-yl-3-pyridinyl)methylsulfamoyl]phenyl]acetamide

N-[4-[(2-pyrazol-1-yl-3-pyridinyl)methylsulfamoyl]phenyl]acetamide (PubChem CID 55663375) has the molecular formula C17H17N5O3S and a molecular weight of 371.42 g/mol. Its IUPAC name is N-[4-[(2-pyrazol-1-yl-3-pyridinyl)methylsulfamoyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[(2-pyrazol-1-yl-3-pyridinyl)methylsulfamoyl]phenyl]acetamide
PubChem CID55663375
Molecular FormulaC17H17N5O3S
Molecular Weight371.42 g/mol
Exact Mass371.11
IUPAC NameN-[4-[(2-pyrazol-1-yl-3-pyridinyl)methylsulfamoyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)NCc2cccnc2-n2cccn2)cc1
InChIInChI=1S/C17H17N5O3S/c1-13(23)21-15-5-7-16(8-6-15)26(24,25)20-12-14-4-2-9-18-17(14)22-11-3-10-19-22/h2-11,20H,12H2,1H3,(H,21,23)
InChIKeyCPKMRBKTDCXYEW-UHFFFAOYSA-N
XLogP1.70
TPSA105.98 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.42
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

methyl N-[4-[(2-pyrazol-1-yl-3-pyridinyl)methylcarbamoylamino]phenyl]carbamate
CID 55799910
N-[2-methyl-5-[(2-pyrazol-1-yl-3-pyridinyl)methylcarbamoylamino]phenyl]acetamide
CID 55745163
N-[(2-pyrazol-1-yl-3-pyridinyl)methyl]-3-(trifluoromethoxy)benzenesulfonamide
CID 55663598
N-[4-(benzenesulfonamidomethyl)phenyl]acetamide
CID 32683830
N-[4-(3-pyrrolo[2,3-b]pyridin-1-ylpropylsulfamoyl)phenyl]acetamide
CID 90556439
N-[2-methoxy-4-[(2-pyrazol-1-yl-3-pyridinyl)methylcarbamoylamino]phenyl]acetamide
CID 154796474
N-(cyclopropylmethyl)-6-[(2-pyrazol-1-yl-3-pyridinyl)methylamino]pyridine-3-sulfonamide
CID 154743293
2-(methylamino)-N-[(2-pyrazol-1-yl-3-pyridinyl)methyl]acetamide
CID 120703672
N-[4-(1H-1,2,4-triazol-5-ylmethylsulfamoyl)phenyl]acetamide
CID 60983716
N-[4-[(1,2,5-trimethylpyrrol-3-yl)methylsulfamoyl]phenyl]acetamide
CID 110642115
N-[4-[(4-methylphenyl)methylsulfamoyl]phenyl]acetamide
CID 669174
2-phenoxy-N-[(2-pyrazol-1-yl-3-pyridinyl)methyl]propanamide
CID 46431766

Frequently Asked Questions

What is the IUPAC name of N-[4-[(2-pyrazol-1-yl-3-pyridinyl)methylsulfamoyl]phenyl]acetamide?
The IUPAC name of N-[4-[(2-pyrazol-1-yl-3-pyridinyl)methylsulfamoyl]phenyl]acetamide (CID 55663375) is N-[4-[(2-pyrazol-1-yl-3-pyridinyl)methylsulfamoyl]phenyl]acetamide.
What is the SMILES notation for N-[4-[(2-pyrazol-1-yl-3-pyridinyl)methylsulfamoyl]phenyl]acetamide?
The canonical SMILES for N-[4-[(2-pyrazol-1-yl-3-pyridinyl)methylsulfamoyl]phenyl]acetamide is CC(=O)Nc1ccc(S(=O)(=O)NCc2cccnc2-n2cccn2)cc1.
What is the InChIKey of N-[4-[(2-pyrazol-1-yl-3-pyridinyl)methylsulfamoyl]phenyl]acetamide?
The InChIKey is CPKMRBKTDCXYEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N5O3S/c1-13(23)21-15-5-7-16(8-6-15)26(24,25)20-12-14-4-2-9-18-17(14)22-11-3-10-19-22/h2-11,20H,12H2,1H3,(H,21,23).
What are the key properties of N-[4-[(2-pyrazol-1-yl-3-pyridinyl)methylsulfamoyl]phenyl]acetamide?
N-[4-[(2-pyrazol-1-yl-3-pyridinyl)methylsulfamoyl]phenyl]acetamide has a molecular weight of 371.42 g/mol, XLogP of 1.70, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(2-pyrazol-1-yl-3-pyridinyl)methylsulfamoyl]phenyl]acetamide is sourced from PubChem (CID 55663375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).