(1-aminocyclohexyl)methanesulfonamide

C7H16N2O2S — CID 89233858

IUPAC(1-aminocyclohexyl)methanesulfonamide
SMILESNC1(CS(N)(=O)=O)CCCCC1
InChIInChI=1S/C7H16N2O2S/c8-7(6-12(9,10)11)4-2-1-3-5-7/h1-6,8H2,(H2,9,10,11)
InChIKeyTZRBQKYEXJXFQH-UHFFFAOYSA-N
MW192.28 g/mol
LogP-0.06
Rot. Bonds2

About (1-aminocyclohexyl)methanesulfonamide

(1-aminocyclohexyl)methanesulfonamide (PubChem CID 89233858) has the molecular formula C7H16N2O2S and a molecular weight of 192.28 g/mol. Its IUPAC name is (1-aminocyclohexyl)methanesulfonamide.

Molecular Properties

Compound Name(1-aminocyclohexyl)methanesulfonamide
PubChem CID89233858
Molecular FormulaC7H16N2O2S
Molecular Weight192.28 g/mol
Exact Mass192.09
IUPAC Name(1-aminocyclohexyl)methanesulfonamide
SMILESNC1(CS(N)(=O)=O)CCCCC1
InChIInChI=1S/C7H16N2O2S/c8-7(6-12(9,10)11)4-2-1-3-5-7/h1-6,8H2,(H2,9,10,11)
InChIKeyTZRBQKYEXJXFQH-UHFFFAOYSA-N
XLogP-0.06
TPSA86.18 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.28
LogP ≤ 5-0.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (1-aminocyclohexyl)methanesulfonamide?
The IUPAC name of (1-aminocyclohexyl)methanesulfonamide (CID 89233858) is (1-aminocyclohexyl)methanesulfonamide.
What is the SMILES notation for (1-aminocyclohexyl)methanesulfonamide?
The canonical SMILES for (1-aminocyclohexyl)methanesulfonamide is NC1(CS(N)(=O)=O)CCCCC1.
What is the InChIKey of (1-aminocyclohexyl)methanesulfonamide?
The InChIKey is TZRBQKYEXJXFQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O2S/c8-7(6-12(9,10)11)4-2-1-3-5-7/h1-6,8H2,(H2,9,10,11).
What are the key properties of (1-aminocyclohexyl)methanesulfonamide?
(1-aminocyclohexyl)methanesulfonamide has a molecular weight of 192.28 g/mol, XLogP of -0.06, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-aminocyclohexyl)methanesulfonamide is sourced from PubChem (CID 89233858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).