2-chloro-N-[(2-hydroxycyclohexyl)methyl]-1,3-thiazole-5-sulfonamide

C10H15ClN2O3S2 — CID 64911997

IUPAC2-chloro-N-[(2-hydroxycyclohexyl)methyl]-1,3-thiazole-5-sulfonamide
SMILESO=S(=O)(NCC1CCCCC1O)c1cnc(Cl)s1
InChIInChI=1S/C10H15ClN2O3S2/c11-10-12-6-9(17-10)18(15,16)13-5-7-3-1-2-4-8(7)14/h6-8,13-14H,1-5H2
InChIKeyKSNOZFFELCHUFP-UHFFFAOYSA-N
MW310.83 g/mol
LogP1.63
Rot. Bonds4

About 2-chloro-N-[(2-hydroxycyclohexyl)methyl]-1,3-thiazole-5-sulfonamide

2-chloro-N-[(2-hydroxycyclohexyl)methyl]-1,3-thiazole-5-sulfonamide (PubChem CID 64911997) has the molecular formula C10H15ClN2O3S2 and a molecular weight of 310.83 g/mol. Its IUPAC name is 2-chloro-N-[(2-hydroxycyclohexyl)methyl]-1,3-thiazole-5-sulfonamide.

Molecular Properties

Compound Name2-chloro-N-[(2-hydroxycyclohexyl)methyl]-1,3-thiazole-5-sulfonamide
PubChem CID64911997
Molecular FormulaC10H15ClN2O3S2
Molecular Weight310.83 g/mol
Exact Mass310.02
IUPAC Name2-chloro-N-[(2-hydroxycyclohexyl)methyl]-1,3-thiazole-5-sulfonamide
SMILESO=S(=O)(NCC1CCCCC1O)c1cnc(Cl)s1
InChIInChI=1S/C10H15ClN2O3S2/c11-10-12-6-9(17-10)18(15,16)13-5-7-3-1-2-4-8(7)14/h6-8,13-14H,1-5H2
InChIKeyKSNOZFFELCHUFP-UHFFFAOYSA-N
XLogP1.63
TPSA79.29 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.83
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-chloro-N-[(2-hydroxycyclohexyl)methyl]-1,3-thiazole-5-sulfonamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[(2-hydroxycyclohexyl)methyl]-1,3-thiazole-5-sulfonamide?
The IUPAC name of 2-chloro-N-[(2-hydroxycyclohexyl)methyl]-1,3-thiazole-5-sulfonamide (CID 64911997) is 2-chloro-N-[(2-hydroxycyclohexyl)methyl]-1,3-thiazole-5-sulfonamide.
What is the SMILES notation for 2-chloro-N-[(2-hydroxycyclohexyl)methyl]-1,3-thiazole-5-sulfonamide?
The canonical SMILES for 2-chloro-N-[(2-hydroxycyclohexyl)methyl]-1,3-thiazole-5-sulfonamide is O=S(=O)(NCC1CCCCC1O)c1cnc(Cl)s1.
What is the InChIKey of 2-chloro-N-[(2-hydroxycyclohexyl)methyl]-1,3-thiazole-5-sulfonamide?
The InChIKey is KSNOZFFELCHUFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15ClN2O3S2/c11-10-12-6-9(17-10)18(15,16)13-5-7-3-1-2-4-8(7)14/h6-8,13-14H,1-5H2.
What are the key properties of 2-chloro-N-[(2-hydroxycyclohexyl)methyl]-1,3-thiazole-5-sulfonamide?
2-chloro-N-[(2-hydroxycyclohexyl)methyl]-1,3-thiazole-5-sulfonamide has a molecular weight of 310.83 g/mol, XLogP of 1.63, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[(2-hydroxycyclohexyl)methyl]-1,3-thiazole-5-sulfonamide is sourced from PubChem (CID 64911997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).