2-[1-[(methylsulfamoylamino)methyl]cyclopropyl]ethanamine

C7H17N3O2S — CID 114813041

IUPAC2-[1-[(methylsulfamoylamino)methyl]cyclopropyl]ethanamine
SMILESCNS(=O)(=O)NCC1(CCN)CC1
InChIInChI=1S/C7H17N3O2S/c1-9-13(11,12)10-6-7(2-3-7)4-5-8/h9-10H,2-6,8H2,1H3
InChIKeyAYPMAROXOXNENF-UHFFFAOYSA-N
MW207.30 g/mol
LogP-0.83
Rot. Bonds6

About 2-[1-[(methylsulfamoylamino)methyl]cyclopropyl]ethanamine

2-[1-[(methylsulfamoylamino)methyl]cyclopropyl]ethanamine (PubChem CID 114813041) has the molecular formula C7H17N3O2S and a molecular weight of 207.30 g/mol. Its IUPAC name is 2-[1-[(methylsulfamoylamino)methyl]cyclopropyl]ethanamine.

Molecular Properties

Compound Name2-[1-[(methylsulfamoylamino)methyl]cyclopropyl]ethanamine
PubChem CID114813041
Molecular FormulaC7H17N3O2S
Molecular Weight207.30 g/mol
Exact Mass207.10
IUPAC Name2-[1-[(methylsulfamoylamino)methyl]cyclopropyl]ethanamine
SMILESCNS(=O)(=O)NCC1(CCN)CC1
InChIInChI=1S/C7H17N3O2S/c1-9-13(11,12)10-6-7(2-3-7)4-5-8/h9-10H,2-6,8H2,1H3
InChIKeyAYPMAROXOXNENF-UHFFFAOYSA-N
XLogP-0.83
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.30
LogP ≤ 5-0.83
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(1-methylcyclopropyl)ethyl]methanesulfonamide
CID 131214766
N-[[1-(2-aminoethyl)cyclopropyl]methylsulfamoyl]-2,2,2-trifluoroethanamine
CID 114813039
3,3,4,4-tetramethyl-N-(methylsulfamoyl)pentan-1-amine
CID 20706577
3,3-Dimethyl-1-(sulfamoylamino)butane
CID 57664623
1-Propan-2-yl-1-[(sulfamoylamino)methyl]cyclopropane
CID 103743750
4,4-dimethyl-N-(methylsulfamoyl)pentan-1-amine
CID 110611315
1-Amino-3,3-dimethyl-5-[methyl(sulfamoyl)amino]pentane
CID 141231013
3-Ethyl-1-(sulfamoylamino)pentane
CID 167049503
1-Ethyl-1-[(sulfamoylamino)methyl]cyclopropane
CID 103736182
1-Propyl-1-[(sulfamoylamino)methyl]cyclopropane
CID 103761625
1-[[[3-Aminopropyl(methyl)sulfamoyl]amino]methyl]-1-ethylcyclopropane
CID 105692863
2,2-dimethyl-N-(methylsulfamoyl)butane-1,4-diamine
CID 106141528

Frequently Asked Questions

What is the IUPAC name of 2-[1-[(methylsulfamoylamino)methyl]cyclopropyl]ethanamine?
The IUPAC name of 2-[1-[(methylsulfamoylamino)methyl]cyclopropyl]ethanamine (CID 114813041) is 2-[1-[(methylsulfamoylamino)methyl]cyclopropyl]ethanamine.
What is the SMILES notation for 2-[1-[(methylsulfamoylamino)methyl]cyclopropyl]ethanamine?
The canonical SMILES for 2-[1-[(methylsulfamoylamino)methyl]cyclopropyl]ethanamine is CNS(=O)(=O)NCC1(CCN)CC1.
What is the InChIKey of 2-[1-[(methylsulfamoylamino)methyl]cyclopropyl]ethanamine?
The InChIKey is AYPMAROXOXNENF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17N3O2S/c1-9-13(11,12)10-6-7(2-3-7)4-5-8/h9-10H,2-6,8H2,1H3.
What are the key properties of 2-[1-[(methylsulfamoylamino)methyl]cyclopropyl]ethanamine?
2-[1-[(methylsulfamoylamino)methyl]cyclopropyl]ethanamine has a molecular weight of 207.30 g/mol, XLogP of -0.83, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[(methylsulfamoylamino)methyl]cyclopropyl]ethanamine is sourced from PubChem (CID 114813041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).