N-[5-[(5-methyl-1,2-oxazol-3-yl)methylsulfonylamino]-2-pyridinyl]cyclopropanecarboxamide

C14H16N4O4S — CID 71906050

IUPACN-[5-[(5-methyl-1,2-oxazol-3-yl)methylsulfonylamino]-2-pyridinyl]cyclopropanecarboxamide
SMILESCc1cc(CS(=O)(=O)Nc2ccc(NC(=O)C3CC3)nc2)no1
InChIInChI=1S/C14H16N4O4S/c1-9-6-12(17-22-9)8-23(20,21)18-11-4-5-13(15-7-11)16-14(19)10-2-3-10/h4-7,10,18H,2-3,8H2,1H3,(H,15,16,19)
InChIKeyPTFAKHCOHLWNIG-UHFFFAOYSA-N
MW336.37 g/mol
LogP1.67
Rot. Bonds6

About N-[5-[(5-methyl-1,2-oxazol-3-yl)methylsulfonylamino]-2-pyridinyl]cyclopropanecarboxamide

N-[5-[(5-methyl-1,2-oxazol-3-yl)methylsulfonylamino]-2-pyridinyl]cyclopropanecarboxamide (PubChem CID 71906050) has the molecular formula C14H16N4O4S and a molecular weight of 336.37 g/mol. Its IUPAC name is N-[5-[(5-methyl-1,2-oxazol-3-yl)methylsulfonylamino]-2-pyridinyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[5-[(5-methyl-1,2-oxazol-3-yl)methylsulfonylamino]-2-pyridinyl]cyclopropanecarboxamide
PubChem CID71906050
Molecular FormulaC14H16N4O4S
Molecular Weight336.37 g/mol
Exact Mass336.09
IUPAC NameN-[5-[(5-methyl-1,2-oxazol-3-yl)methylsulfonylamino]-2-pyridinyl]cyclopropanecarboxamide
SMILESCc1cc(CS(=O)(=O)Nc2ccc(NC(=O)C3CC3)nc2)no1
InChIInChI=1S/C14H16N4O4S/c1-9-6-12(17-22-9)8-23(20,21)18-11-4-5-13(15-7-11)16-14(19)10-2-3-10/h4-7,10,18H,2-3,8H2,1H3,(H,15,16,19)
InChIKeyPTFAKHCOHLWNIG-UHFFFAOYSA-N
XLogP1.67
TPSA114.19 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.37
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-[5-[(5-methyl-1,2-oxazol-3-yl)methylsulfonylamino]-2-pyridinyl]acetic acid
CID 107339792
N-(6-bromo-3-pyridinyl)-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide
CID 103895771
N-(5-amino-2-pyridinyl)-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide
CID 43144678
N-[2-[(5-methyl-1,2-oxazol-3-yl)methylsulfonylamino]ethyl]cyclopropanecarboxamide
CID 115633596
N-[6-[(5-methyl-1,2-oxazol-3-yl)amino]-3-pyridinyl]oxane-4-carboxamide
CID 113023357
N-[5-(3,4-dimethylanilino)-2-pyridinyl]cyclopropanecarboxamide
CID 113032093
N-(4-amino-3-chlorophenyl)-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide
CID 43604495
N-[5-[[4-(dimethylsulfamoyl)phenyl]sulfonylamino]-2-pyridinyl]cyclopropanecarboxamide
CID 126817552
N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]cyclohexanecarboxamide
CID 1181036
4-N-(5-methyl-1,2-oxazol-3-yl)-1-N-phenylcyclohexane-1,4-dicarboxamide
CID 109150357
N-(4-amino-3-methoxyphenyl)-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide
CID 43605050
N-[5-(cyclopropylamino)-2-pyridinyl]cyclopropanecarboxamide
CID 113023685

Frequently Asked Questions

What is the IUPAC name of N-[5-[(5-methyl-1,2-oxazol-3-yl)methylsulfonylamino]-2-pyridinyl]cyclopropanecarboxamide?
The IUPAC name of N-[5-[(5-methyl-1,2-oxazol-3-yl)methylsulfonylamino]-2-pyridinyl]cyclopropanecarboxamide (CID 71906050) is N-[5-[(5-methyl-1,2-oxazol-3-yl)methylsulfonylamino]-2-pyridinyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[5-[(5-methyl-1,2-oxazol-3-yl)methylsulfonylamino]-2-pyridinyl]cyclopropanecarboxamide?
The canonical SMILES for N-[5-[(5-methyl-1,2-oxazol-3-yl)methylsulfonylamino]-2-pyridinyl]cyclopropanecarboxamide is Cc1cc(CS(=O)(=O)Nc2ccc(NC(=O)C3CC3)nc2)no1.
What is the InChIKey of N-[5-[(5-methyl-1,2-oxazol-3-yl)methylsulfonylamino]-2-pyridinyl]cyclopropanecarboxamide?
The InChIKey is PTFAKHCOHLWNIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O4S/c1-9-6-12(17-22-9)8-23(20,21)18-11-4-5-13(15-7-11)16-14(19)10-2-3-10/h4-7,10,18H,2-3,8H2,1H3,(H,15,16,19).
What are the key properties of N-[5-[(5-methyl-1,2-oxazol-3-yl)methylsulfonylamino]-2-pyridinyl]cyclopropanecarboxamide?
N-[5-[(5-methyl-1,2-oxazol-3-yl)methylsulfonylamino]-2-pyridinyl]cyclopropanecarboxamide has a molecular weight of 336.37 g/mol, XLogP of 1.67, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[(5-methyl-1,2-oxazol-3-yl)methylsulfonylamino]-2-pyridinyl]cyclopropanecarboxamide is sourced from PubChem (CID 71906050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).