N-[6-(cycloheptylamino)pyridazin-3-yl]-5-ethylthiophene-2-sulfonamide

C17H24N4O2S2 — CID 113044438

IUPACN-[6-(cycloheptylamino)pyridazin-3-yl]-5-ethylthiophene-2-sulfonamide
SMILESCCc1ccc(S(=O)(=O)Nc2ccc(NC3CCCCCC3)nn2)s1
InChIInChI=1S/C17H24N4O2S2/c1-2-14-9-12-17(24-14)25(22,23)21-16-11-10-15(19-20-16)18-13-7-5-3-4-6-8-13/h9-13H,2-8H2,1H3,(H,18,19)(H,20,21)
InChIKeyIUSCGYYCIHPQKP-UHFFFAOYSA-N
MW380.54 g/mol
LogP4.04
Rot. Bonds6

About N-[6-(cycloheptylamino)pyridazin-3-yl]-5-ethylthiophene-2-sulfonamide

N-[6-(cycloheptylamino)pyridazin-3-yl]-5-ethylthiophene-2-sulfonamide (PubChem CID 113044438) has the molecular formula C17H24N4O2S2 and a molecular weight of 380.54 g/mol. Its IUPAC name is N-[6-(cycloheptylamino)pyridazin-3-yl]-5-ethylthiophene-2-sulfonamide.

Molecular Properties

Compound NameN-[6-(cycloheptylamino)pyridazin-3-yl]-5-ethylthiophene-2-sulfonamide
PubChem CID113044438
Molecular FormulaC17H24N4O2S2
Molecular Weight380.54 g/mol
Exact Mass380.13
IUPAC NameN-[6-(cycloheptylamino)pyridazin-3-yl]-5-ethylthiophene-2-sulfonamide
SMILESCCc1ccc(S(=O)(=O)Nc2ccc(NC3CCCCCC3)nn2)s1
InChIInChI=1S/C17H24N4O2S2/c1-2-14-9-12-17(24-14)25(22,23)21-16-11-10-15(19-20-16)18-13-7-5-3-4-6-8-13/h9-13H,2-8H2,1H3,(H,18,19)(H,20,21)
InChIKeyIUSCGYYCIHPQKP-UHFFFAOYSA-N
XLogP4.04
TPSA83.98 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.54
LogP ≤ 54.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-[6-(cycloheptylamino)pyridazin-3-yl]-5-ethylthiophene-2-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-ethyl-N-[6-(propan-2-ylamino)pyridazin-3-yl]thiophene-2-sulfonamide
CID 113038015
N-[6-(cyclohexylamino)pyridazin-3-yl]-4-ethylbenzenesulfonamide
CID 113039144
N-[6-(cyclohexylamino)pyridazin-3-yl]-4-ethoxybenzenesulfonamide
CID 113039174
N-[6-(cycloheptylamino)pyridazin-3-yl]-4-methoxybenzenesulfonamide
CID 16941956
5-ethyl-N-(5-piperidin-1-yl-2-pyridinyl)thiophene-2-sulfonamide
CID 113024663
N-[6-(cyclopropylamino)pyridazin-3-yl]-4-ethoxybenzenesulfonamide
CID 113038166
N-[6-(cyclopentylamino)pyridazin-3-yl]-4-methylbenzenesulfonamide
CID 16941993
N-cyclopropyl-5-ethylthiophene-2-sulfonamide
CID 61061009
5-ethyl-N-[6-(N-methylanilino)pyridazin-3-yl]thiophene-2-sulfonamide
CID 113046005
5-ethyl-N-pyrimidin-2-ylthiophene-2-sulfonamide
CID 75517993
N-(2-amino-1-cyclohexylethyl)-5-ethylthiophene-2-sulfonamide
CID 115309311
N-[6-(2,4-difluoroanilino)pyridazin-3-yl]-5-ethylthiophene-2-sulfonamide
CID 113050558

Frequently Asked Questions

What is the IUPAC name of N-[6-(cycloheptylamino)pyridazin-3-yl]-5-ethylthiophene-2-sulfonamide?
The IUPAC name of N-[6-(cycloheptylamino)pyridazin-3-yl]-5-ethylthiophene-2-sulfonamide (CID 113044438) is N-[6-(cycloheptylamino)pyridazin-3-yl]-5-ethylthiophene-2-sulfonamide.
What is the SMILES notation for N-[6-(cycloheptylamino)pyridazin-3-yl]-5-ethylthiophene-2-sulfonamide?
The canonical SMILES for N-[6-(cycloheptylamino)pyridazin-3-yl]-5-ethylthiophene-2-sulfonamide is CCc1ccc(S(=O)(=O)Nc2ccc(NC3CCCCCC3)nn2)s1.
What is the InChIKey of N-[6-(cycloheptylamino)pyridazin-3-yl]-5-ethylthiophene-2-sulfonamide?
The InChIKey is IUSCGYYCIHPQKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4O2S2/c1-2-14-9-12-17(24-14)25(22,23)21-16-11-10-15(19-20-16)18-13-7-5-3-4-6-8-13/h9-13H,2-8H2,1H3,(H,18,19)(H,20,21).
What are the key properties of N-[6-(cycloheptylamino)pyridazin-3-yl]-5-ethylthiophene-2-sulfonamide?
N-[6-(cycloheptylamino)pyridazin-3-yl]-5-ethylthiophene-2-sulfonamide has a molecular weight of 380.54 g/mol, XLogP of 4.04, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(cycloheptylamino)pyridazin-3-yl]-5-ethylthiophene-2-sulfonamide is sourced from PubChem (CID 113044438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).