N-[(2R)-2-aminohexyl]methanesulfonamide

C7H18N2O2S — CID 122599145

IUPACN-[(2R)-2-aminohexyl]methanesulfonamide
SMILESCCCC[C@@H](N)CNS(C)(=O)=O
InChIInChI=1S/C7H18N2O2S/c1-3-4-5-7(8)6-9-12(2,10)11/h7,9H,3-6,8H2,1-2H3/t7-/m1/s1
InChIKeyFPJMHLVPNXPRDN-SSDOTTSWSA-N
MW194.30 g/mol
LogP0.05
Rot. Bonds6

About N-[(2R)-2-aminohexyl]methanesulfonamide

N-[(2R)-2-aminohexyl]methanesulfonamide (PubChem CID 122599145) has the molecular formula C7H18N2O2S and a molecular weight of 194.30 g/mol. Its IUPAC name is N-[(2R)-2-aminohexyl]methanesulfonamide.

Molecular Properties

Compound NameN-[(2R)-2-aminohexyl]methanesulfonamide
PubChem CID122599145
Molecular FormulaC7H18N2O2S
Molecular Weight194.30 g/mol
Exact Mass194.11
IUPAC NameN-[(2R)-2-aminohexyl]methanesulfonamide
SMILESCCCC[C@@H](N)CNS(C)(=O)=O
InChIInChI=1S/C7H18N2O2S/c1-3-4-5-7(8)6-9-12(2,10)11/h7,9H,3-6,8H2,1-2H3/t7-/m1/s1
InChIKeyFPJMHLVPNXPRDN-SSDOTTSWSA-N
XLogP0.05
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.30
LogP ≤ 50.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-aminohexyl]methanesulfonamide?
The IUPAC name of N-[(2R)-2-aminohexyl]methanesulfonamide (CID 122599145) is N-[(2R)-2-aminohexyl]methanesulfonamide.
What is the SMILES notation for N-[(2R)-2-aminohexyl]methanesulfonamide?
The canonical SMILES for N-[(2R)-2-aminohexyl]methanesulfonamide is CCCC[C@@H](N)CNS(C)(=O)=O.
What is the InChIKey of N-[(2R)-2-aminohexyl]methanesulfonamide?
The InChIKey is FPJMHLVPNXPRDN-SSDOTTSWSA-N. The full InChI is InChI=1S/C7H18N2O2S/c1-3-4-5-7(8)6-9-12(2,10)11/h7,9H,3-6,8H2,1-2H3/t7-/m1/s1.
What are the key properties of N-[(2R)-2-aminohexyl]methanesulfonamide?
N-[(2R)-2-aminohexyl]methanesulfonamide has a molecular weight of 194.30 g/mol, XLogP of 0.05, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-aminohexyl]methanesulfonamide is sourced from PubChem (CID 122599145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).