2-amino-N-[(1-methylpyrazol-3-yl)methyl]pyridine-3-sulfonamide

C10H13N5O2S — CID 82882628

IUPAC2-amino-N-[(1-methylpyrazol-3-yl)methyl]pyridine-3-sulfonamide
SMILESCn1ccc(CNS(=O)(=O)c2cccnc2N)n1
InChIInChI=1S/C10H13N5O2S/c1-15-6-4-8(14-15)7-13-18(16,17)9-3-2-5-12-10(9)11/h2-6,13H,7H2,1H3,(H2,11,12)
InChIKeyRXBUKDQGSQPEMM-UHFFFAOYSA-N
MW267.31 g/mol
LogP-0.12
Rot. Bonds4

About 2-amino-N-[(1-methylpyrazol-3-yl)methyl]pyridine-3-sulfonamide

2-amino-N-[(1-methylpyrazol-3-yl)methyl]pyridine-3-sulfonamide (PubChem CID 82882628) has the molecular formula C10H13N5O2S and a molecular weight of 267.31 g/mol. Its IUPAC name is 2-amino-N-[(1-methylpyrazol-3-yl)methyl]pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-amino-N-[(1-methylpyrazol-3-yl)methyl]pyridine-3-sulfonamide
PubChem CID82882628
Molecular FormulaC10H13N5O2S
Molecular Weight267.31 g/mol
Exact Mass267.08
IUPAC Name2-amino-N-[(1-methylpyrazol-3-yl)methyl]pyridine-3-sulfonamide
SMILESCn1ccc(CNS(=O)(=O)c2cccnc2N)n1
InChIInChI=1S/C10H13N5O2S/c1-15-6-4-8(14-15)7-13-18(16,17)9-3-2-5-12-10(9)11/h2-6,13H,7H2,1H3,(H2,11,12)
InChIKeyRXBUKDQGSQPEMM-UHFFFAOYSA-N
XLogP-0.12
TPSA102.90 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.31
LogP ≤ 5-0.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-(ethylamino)-N-[(1-methylpyrazol-3-yl)methyl]pyridine-3-sulfonamide
CID 82875234
3-amino-N-[(1-methylpyrazol-3-yl)methyl]benzenesulfonamide
CID 82881991
5-amino-2-fluoro-N-[(1-methylpyrazol-3-yl)methyl]benzenesulfonamide
CID 82882897
1-methyl-3-[(sulfamoylamino)methyl]pyrazole
CID 112548279
5-amino-2-fluoro-3-methyl-N-[(1-methylpyrazol-3-yl)methyl]benzenesulfonamide
CID 82882446
2,4-dimethyl-N-[(1-methylpyrazol-3-yl)methyl]benzenesulfonamide
CID 22207740
4-(aminomethyl)-N-[(1-methylpyrazol-3-yl)methyl]benzenesulfonamide
CID 82882484
2,5-difluoro-N-[(1-methylpyrazol-3-yl)methyl]benzenesulfonamide
CID 22207747
4-amino-2,6-dibromo-N-[(1-methylpyrazol-3-yl)methyl]benzenesulfonamide
CID 82882267
N-[(1-methylpyrazol-3-yl)methyl]ethanesulfonamide
CID 22207761
2-amino-N-[(2-methoxyphenyl)methyl]pyridine-3-sulfonamide
CID 62164569
1-(2-aminophenyl)-N-[(1-methylpyrazol-3-yl)methyl]methanesulfonamide
CID 82882627

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[(1-methylpyrazol-3-yl)methyl]pyridine-3-sulfonamide?
The IUPAC name of 2-amino-N-[(1-methylpyrazol-3-yl)methyl]pyridine-3-sulfonamide (CID 82882628) is 2-amino-N-[(1-methylpyrazol-3-yl)methyl]pyridine-3-sulfonamide.
What is the SMILES notation for 2-amino-N-[(1-methylpyrazol-3-yl)methyl]pyridine-3-sulfonamide?
The canonical SMILES for 2-amino-N-[(1-methylpyrazol-3-yl)methyl]pyridine-3-sulfonamide is Cn1ccc(CNS(=O)(=O)c2cccnc2N)n1.
What is the InChIKey of 2-amino-N-[(1-methylpyrazol-3-yl)methyl]pyridine-3-sulfonamide?
The InChIKey is RXBUKDQGSQPEMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5O2S/c1-15-6-4-8(14-15)7-13-18(16,17)9-3-2-5-12-10(9)11/h2-6,13H,7H2,1H3,(H2,11,12).
What are the key properties of 2-amino-N-[(1-methylpyrazol-3-yl)methyl]pyridine-3-sulfonamide?
2-amino-N-[(1-methylpyrazol-3-yl)methyl]pyridine-3-sulfonamide has a molecular weight of 267.31 g/mol, XLogP of -0.12, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[(1-methylpyrazol-3-yl)methyl]pyridine-3-sulfonamide is sourced from PubChem (CID 82882628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).