1-(methylamino)-N-(3-methylsulfanylcyclopentyl)propane-2-sulfonamide

C10H22N2O2S2 — CID 106092221

IUPAC1-(methylamino)-N-(3-methylsulfanylcyclopentyl)propane-2-sulfonamide
SMILESCNCC(C)S(=O)(=O)NC1CCC(SC)C1
InChIInChI=1S/C10H22N2O2S2/c1-8(7-11-2)16(13,14)12-9-4-5-10(6-9)15-3/h8-12H,4-7H2,1-3H3
InChIKeyHCIDNIVTCMOSGD-UHFFFAOYSA-N
MW266.43 g/mol
LogP0.80
Rot. Bonds6

About 1-(methylamino)-N-(3-methylsulfanylcyclopentyl)propane-2-sulfonamide

1-(methylamino)-N-(3-methylsulfanylcyclopentyl)propane-2-sulfonamide (PubChem CID 106092221) has the molecular formula C10H22N2O2S2 and a molecular weight of 266.43 g/mol. Its IUPAC name is 1-(methylamino)-N-(3-methylsulfanylcyclopentyl)propane-2-sulfonamide.

Molecular Properties

Compound Name1-(methylamino)-N-(3-methylsulfanylcyclopentyl)propane-2-sulfonamide
PubChem CID106092221
Molecular FormulaC10H22N2O2S2
Molecular Weight266.43 g/mol
Exact Mass266.11
IUPAC Name1-(methylamino)-N-(3-methylsulfanylcyclopentyl)propane-2-sulfonamide
SMILESCNCC(C)S(=O)(=O)NC1CCC(SC)C1
InChIInChI=1S/C10H22N2O2S2/c1-8(7-11-2)16(13,14)12-9-4-5-10(6-9)15-3/h8-12H,4-7H2,1-3H3
InChIKeyHCIDNIVTCMOSGD-UHFFFAOYSA-N
XLogP0.80
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-amino-N-(3-methylsulfanylcyclopentyl)propane-2-sulfonamide
CID 106092181
N-(3,4-dimethylcyclohexyl)-1-(methylamino)propane-2-sulfonamide
CID 106067378
N-(3-ethylcyclohexyl)-1-(methylamino)propane-2-sulfonamide
CID 114141537
N-(3-methylsulfanylcyclopentyl)propane-1-sulfonamide
CID 103697967
N-(2-methylpropyl)-3-methylsulfanylcyclopentan-1-amine
CID 115876615
N-methyl-3-methylsulfanylcyclopentan-1-amine
CID 54595737
N-(1,1-dioxothian-3-yl)-1-(methylamino)propane-2-sulfonamide
CID 106065944
N-cyclooctyl-1-(cyclopropylamino)propane-2-sulfonamide
CID 106058802
1-cyano-N-(3-methylsulfanylcyclohexyl)propane-1-sulfonamide
CID 113338251
N-(3-methylsulfanylcyclopentyl)-1-piperidin-2-ylmethanesulfonamide
CID 114123736
N-(4-methylsulfanylcyclohexyl)-2-(propan-2-ylamino)ethanesulfonamide
CID 114123735
N-(3,4-dimethylcyclohexyl)-1-(propylamino)propane-2-sulfonamide
CID 106067403

Frequently Asked Questions

What is the IUPAC name of 1-(methylamino)-N-(3-methylsulfanylcyclopentyl)propane-2-sulfonamide?
The IUPAC name of 1-(methylamino)-N-(3-methylsulfanylcyclopentyl)propane-2-sulfonamide (CID 106092221) is 1-(methylamino)-N-(3-methylsulfanylcyclopentyl)propane-2-sulfonamide.
What is the SMILES notation for 1-(methylamino)-N-(3-methylsulfanylcyclopentyl)propane-2-sulfonamide?
The canonical SMILES for 1-(methylamino)-N-(3-methylsulfanylcyclopentyl)propane-2-sulfonamide is CNCC(C)S(=O)(=O)NC1CCC(SC)C1.
What is the InChIKey of 1-(methylamino)-N-(3-methylsulfanylcyclopentyl)propane-2-sulfonamide?
The InChIKey is HCIDNIVTCMOSGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O2S2/c1-8(7-11-2)16(13,14)12-9-4-5-10(6-9)15-3/h8-12H,4-7H2,1-3H3.
What are the key properties of 1-(methylamino)-N-(3-methylsulfanylcyclopentyl)propane-2-sulfonamide?
1-(methylamino)-N-(3-methylsulfanylcyclopentyl)propane-2-sulfonamide has a molecular weight of 266.43 g/mol, XLogP of 0.80, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(methylamino)-N-(3-methylsulfanylcyclopentyl)propane-2-sulfonamide is sourced from PubChem (CID 106092221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).