[[(3-amino-4-methylpentyl)-methylsulfamoyl]amino]cyclopropane

C10H23N3O2S — CID 114811297

IUPAC[[(3-amino-4-methylpentyl)-methylsulfamoyl]amino]cyclopropane
SMILESCC(C)C(N)CCN(C)S(=O)(=O)NC1CC1
InChIInChI=1S/C10H23N3O2S/c1-8(2)10(11)6-7-13(3)16(14,15)12-9-4-5-9/h8-10,12H,4-7,11H2,1-3H3
InChIKeyVWNFSYBAKCQKIS-UHFFFAOYSA-N
MW249.38 g/mol
LogP0.29
Rot. Bonds7

About [[(3-amino-4-methylpentyl)-methylsulfamoyl]amino]cyclopropane

[[(3-amino-4-methylpentyl)-methylsulfamoyl]amino]cyclopropane (PubChem CID 114811297) has the molecular formula C10H23N3O2S and a molecular weight of 249.38 g/mol. Its IUPAC name is [[(3-amino-4-methylpentyl)-methylsulfamoyl]amino]cyclopropane.

Molecular Properties

Compound Name[[(3-amino-4-methylpentyl)-methylsulfamoyl]amino]cyclopropane
PubChem CID114811297
Molecular FormulaC10H23N3O2S
Molecular Weight249.38 g/mol
Exact Mass249.15
IUPAC Name[[(3-amino-4-methylpentyl)-methylsulfamoyl]amino]cyclopropane
SMILESCC(C)C(N)CCN(C)S(=O)(=O)NC1CC1
InChIInChI=1S/C10H23N3O2S/c1-8(2)10(11)6-7-13(3)16(14,15)12-9-4-5-9/h8-10,12H,4-7,11H2,1-3H3
InChIKeyVWNFSYBAKCQKIS-UHFFFAOYSA-N
XLogP0.29
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.38
LogP ≤ 50.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-amino-4-methylpentyl)-1-cyclohexyl-N-methylmethanesulfonamide;hydrochloride
CID 119992202
1-N-(cyclopropylsulfamoyl)-3-methylbutane-1,2-diamine
CID 114810889
N-(3-amino-4-methylpentyl)-1,1-difluoro-N-methylmethanesulfonamide
CID 115317705
N-(3-amino-4-methylpentyl)-N-methylpyrrolidine-1-sulfonamide
CID 115317691
N-(3-amino-4-methylpentyl)-4-(cyclopropylsulfamoyl)-N-methylbenzamide;hydrochloride
CID 119659587
N-(3-amino-4-methylpentyl)-N,3-dimethylpiperidine-1-sulfonamide
CID 115317600
2-[(3-amino-4-methylpentyl)-methylamino]-N-(cyclopropylcarbamoyl)acetamide
CID 81490662
1-[[3-aminopropyl(methyl)sulfamoyl]amino]-4-methylsulfanylcyclohexane
CID 114142578
1-(ethylamino)-4-[[methyl(propan-2-yl)sulfamoyl]amino]cyclohexane
CID 54947723
1-amino-4-[[methyl(propan-2-yl)sulfamoyl]amino]cyclohexane
CID 61455775
1-amino-4-[bis(3-methylbutyl)sulfamoylamino]cyclohexane;hydrochloride
CID 119970554
1,4-bis(diethylsulfamoylamino)cyclohexane
CID 31065973

Frequently Asked Questions

What is the IUPAC name of [[(3-amino-4-methylpentyl)-methylsulfamoyl]amino]cyclopropane?
The IUPAC name of [[(3-amino-4-methylpentyl)-methylsulfamoyl]amino]cyclopropane (CID 114811297) is [[(3-amino-4-methylpentyl)-methylsulfamoyl]amino]cyclopropane.
What is the SMILES notation for [[(3-amino-4-methylpentyl)-methylsulfamoyl]amino]cyclopropane?
The canonical SMILES for [[(3-amino-4-methylpentyl)-methylsulfamoyl]amino]cyclopropane is CC(C)C(N)CCN(C)S(=O)(=O)NC1CC1.
What is the InChIKey of [[(3-amino-4-methylpentyl)-methylsulfamoyl]amino]cyclopropane?
The InChIKey is VWNFSYBAKCQKIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N3O2S/c1-8(2)10(11)6-7-13(3)16(14,15)12-9-4-5-9/h8-10,12H,4-7,11H2,1-3H3.
What are the key properties of [[(3-amino-4-methylpentyl)-methylsulfamoyl]amino]cyclopropane?
[[(3-amino-4-methylpentyl)-methylsulfamoyl]amino]cyclopropane has a molecular weight of 249.38 g/mol, XLogP of 0.29, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [[(3-amino-4-methylpentyl)-methylsulfamoyl]amino]cyclopropane is sourced from PubChem (CID 114811297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).