(5-cyclohexylsulfonyl-1,3-thiazol-2-yl)methanamine

C10H16N2O2S2 — CID 130345225

IUPAC(5-cyclohexylsulfonyl-1,3-thiazol-2-yl)methanamine
SMILESNCc1ncc(S(=O)(=O)C2CCCCC2)s1
InChIInChI=1S/C10H16N2O2S2/c11-6-9-12-7-10(15-9)16(13,14)8-4-2-1-3-5-8/h7-8H,1-6,11H2
InChIKeyOUUMRRPPHLTBSN-UHFFFAOYSA-N
MW260.38 g/mol
LogP1.71
Rot. Bonds3

About (5-cyclohexylsulfonyl-1,3-thiazol-2-yl)methanamine

(5-cyclohexylsulfonyl-1,3-thiazol-2-yl)methanamine (PubChem CID 130345225) has the molecular formula C10H16N2O2S2 and a molecular weight of 260.38 g/mol. Its IUPAC name is (5-cyclohexylsulfonyl-1,3-thiazol-2-yl)methanamine.

Molecular Properties

Compound Name(5-cyclohexylsulfonyl-1,3-thiazol-2-yl)methanamine
PubChem CID130345225
Molecular FormulaC10H16N2O2S2
Molecular Weight260.38 g/mol
Exact Mass260.07
IUPAC Name(5-cyclohexylsulfonyl-1,3-thiazol-2-yl)methanamine
SMILESNCc1ncc(S(=O)(=O)C2CCCCC2)s1
InChIInChI=1S/C10H16N2O2S2/c11-6-9-12-7-10(15-9)16(13,14)8-4-2-1-3-5-8/h7-8H,1-6,11H2
InChIKeyOUUMRRPPHLTBSN-UHFFFAOYSA-N
XLogP1.71
TPSA73.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (5-cyclohexylsulfonyl-1,3-thiazol-2-yl)methanamine?
The IUPAC name of (5-cyclohexylsulfonyl-1,3-thiazol-2-yl)methanamine (CID 130345225) is (5-cyclohexylsulfonyl-1,3-thiazol-2-yl)methanamine.
What is the SMILES notation for (5-cyclohexylsulfonyl-1,3-thiazol-2-yl)methanamine?
The canonical SMILES for (5-cyclohexylsulfonyl-1,3-thiazol-2-yl)methanamine is NCc1ncc(S(=O)(=O)C2CCCCC2)s1.
What is the InChIKey of (5-cyclohexylsulfonyl-1,3-thiazol-2-yl)methanamine?
The InChIKey is OUUMRRPPHLTBSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2S2/c11-6-9-12-7-10(15-9)16(13,14)8-4-2-1-3-5-8/h7-8H,1-6,11H2.
What are the key properties of (5-cyclohexylsulfonyl-1,3-thiazol-2-yl)methanamine?
(5-cyclohexylsulfonyl-1,3-thiazol-2-yl)methanamine has a molecular weight of 260.38 g/mol, XLogP of 1.71, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5-cyclohexylsulfonyl-1,3-thiazol-2-yl)methanamine is sourced from PubChem (CID 130345225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).