N-(furan-2-ylmethyl)-N-methyl-1-pyridin-2-ylpyrazole-4-sulfonamide

C14H14N4O3S — CID 71688068

IUPACN-(furan-2-ylmethyl)-N-methyl-1-pyridin-2-ylpyrazole-4-sulfonamide
SMILESCN(Cc1ccco1)S(=O)(=O)c1cnn(-c2ccccn2)c1
InChIInChI=1S/C14H14N4O3S/c1-17(10-12-5-4-8-21-12)22(19,20)13-9-16-18(11-13)14-6-2-3-7-15-14/h2-9,11H,10H2,1H3
InChIKeyOYFVQKVXDRLPJY-UHFFFAOYSA-N
MW318.36 g/mol
LogP1.68
Rot. Bonds5

About N-(furan-2-ylmethyl)-N-methyl-1-pyridin-2-ylpyrazole-4-sulfonamide

N-(furan-2-ylmethyl)-N-methyl-1-pyridin-2-ylpyrazole-4-sulfonamide (PubChem CID 71688068) has the molecular formula C14H14N4O3S and a molecular weight of 318.36 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-N-methyl-1-pyridin-2-ylpyrazole-4-sulfonamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-N-methyl-1-pyridin-2-ylpyrazole-4-sulfonamide
PubChem CID71688068
Molecular FormulaC14H14N4O3S
Molecular Weight318.36 g/mol
Exact Mass318.08
IUPAC NameN-(furan-2-ylmethyl)-N-methyl-1-pyridin-2-ylpyrazole-4-sulfonamide
SMILESCN(Cc1ccco1)S(=O)(=O)c1cnn(-c2ccccn2)c1
InChIInChI=1S/C14H14N4O3S/c1-17(10-12-5-4-8-21-12)22(19,20)13-9-16-18(11-13)14-6-2-3-7-15-14/h2-9,11H,10H2,1H3
InChIKeyOYFVQKVXDRLPJY-UHFFFAOYSA-N
XLogP1.68
TPSA81.23 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.36
LogP ≤ 51.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

N-(cyclobutylmethyl)-N-ethyl-1-pyridin-2-ylpyrazole-4-sulfonamide
CID 171133561
N-[(5-methylfuran-2-yl)methyl]-1-pyridin-2-ylpyrazole-4-sulfonamide
CID 71688165
N-(furan-2-ylmethyl)-4-iodo-N-methylbenzenesulfonamide
CID 3820660
6-cyano-N-(furan-2-ylmethyl)-N-methylpyridine-3-sulfonamide
CID 115602451
N-(furan-2-ylmethyl)-4-methoxy-N-methylbenzenesulfonamide
CID 7510148
N-methyl-1-propyl-N-[(3-pyridin-2-yl-1,2-oxazol-5-yl)methyl]pyrazole-4-sulfonamide
CID 131939149
N-(furan-2-ylmethyl)-N-methyl-4-propan-2-ylbenzenesulfonamide
CID 51169518
N-(furan-2-ylmethyl)-N-methyl-4-methylsulfanylbenzenesulfonamide
CID 49237525
3-amino-4-ethyl-N-(furan-2-ylmethyl)-N-methylbenzenesulfonamide
CID 43526678
N-(furan-2-ylmethyl)-N,5-dimethyl-1H-pyrazole-4-sulfonamide
CID 54929638
4-(cyanomethyl)-N-(furan-2-ylmethyl)-N-methylbenzenesulfonamide
CID 79185156
3-amino-5-fluoro-N-(furan-2-ylmethyl)-N-methylbenzenesulfonamide
CID 63322045

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-N-methyl-1-pyridin-2-ylpyrazole-4-sulfonamide?
The IUPAC name of N-(furan-2-ylmethyl)-N-methyl-1-pyridin-2-ylpyrazole-4-sulfonamide (CID 71688068) is N-(furan-2-ylmethyl)-N-methyl-1-pyridin-2-ylpyrazole-4-sulfonamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-N-methyl-1-pyridin-2-ylpyrazole-4-sulfonamide?
The canonical SMILES for N-(furan-2-ylmethyl)-N-methyl-1-pyridin-2-ylpyrazole-4-sulfonamide is CN(Cc1ccco1)S(=O)(=O)c1cnn(-c2ccccn2)c1.
What is the InChIKey of N-(furan-2-ylmethyl)-N-methyl-1-pyridin-2-ylpyrazole-4-sulfonamide?
The InChIKey is OYFVQKVXDRLPJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4O3S/c1-17(10-12-5-4-8-21-12)22(19,20)13-9-16-18(11-13)14-6-2-3-7-15-14/h2-9,11H,10H2,1H3.
What are the key properties of N-(furan-2-ylmethyl)-N-methyl-1-pyridin-2-ylpyrazole-4-sulfonamide?
N-(furan-2-ylmethyl)-N-methyl-1-pyridin-2-ylpyrazole-4-sulfonamide has a molecular weight of 318.36 g/mol, XLogP of 1.68, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-N-methyl-1-pyridin-2-ylpyrazole-4-sulfonamide is sourced from PubChem (CID 71688068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).