N'-cyclopentyl-N'-[methyl(propan-2-yl)sulfamoyl]ethane-1,2-diamine

C11H25N3O2S — CID 55242943

IUPACN'-cyclopentyl-N'-[methyl(propan-2-yl)sulfamoyl]ethane-1,2-diamine
SMILESCC(C)N(C)S(=O)(=O)N(CCN)C1CCCC1
InChIInChI=1S/C11H25N3O2S/c1-10(2)13(3)17(15,16)14(9-8-12)11-6-4-5-7-11/h10-11H,4-9,12H2,1-3H3
InChIKeyVOJMSAZQOHKELA-UHFFFAOYSA-N
MW263.41 g/mol
LogP0.77
Rot. Bonds6

About N'-cyclopentyl-N'-[methyl(propan-2-yl)sulfamoyl]ethane-1,2-diamine

N'-cyclopentyl-N'-[methyl(propan-2-yl)sulfamoyl]ethane-1,2-diamine (PubChem CID 55242943) has the molecular formula C11H25N3O2S and a molecular weight of 263.41 g/mol. Its IUPAC name is N'-cyclopentyl-N'-[methyl(propan-2-yl)sulfamoyl]ethane-1,2-diamine.

Molecular Properties

Compound NameN'-cyclopentyl-N'-[methyl(propan-2-yl)sulfamoyl]ethane-1,2-diamine
PubChem CID55242943
Molecular FormulaC11H25N3O2S
Molecular Weight263.41 g/mol
Exact Mass263.17
IUPAC NameN'-cyclopentyl-N'-[methyl(propan-2-yl)sulfamoyl]ethane-1,2-diamine
SMILESCC(C)N(C)S(=O)(=O)N(CCN)C1CCCC1
InChIInChI=1S/C11H25N3O2S/c1-10(2)13(3)17(15,16)14(9-8-12)11-6-4-5-7-11/h10-11H,4-9,12H2,1-3H3
InChIKeyVOJMSAZQOHKELA-UHFFFAOYSA-N
XLogP0.77
TPSA66.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.41
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N'-cyclopentyl-N'-[methyl(propan-2-yl)sulfamoyl]ethane-1,2-diamine?
The IUPAC name of N'-cyclopentyl-N'-[methyl(propan-2-yl)sulfamoyl]ethane-1,2-diamine (CID 55242943) is N'-cyclopentyl-N'-[methyl(propan-2-yl)sulfamoyl]ethane-1,2-diamine.
What is the SMILES notation for N'-cyclopentyl-N'-[methyl(propan-2-yl)sulfamoyl]ethane-1,2-diamine?
The canonical SMILES for N'-cyclopentyl-N'-[methyl(propan-2-yl)sulfamoyl]ethane-1,2-diamine is CC(C)N(C)S(=O)(=O)N(CCN)C1CCCC1.
What is the InChIKey of N'-cyclopentyl-N'-[methyl(propan-2-yl)sulfamoyl]ethane-1,2-diamine?
The InChIKey is VOJMSAZQOHKELA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N3O2S/c1-10(2)13(3)17(15,16)14(9-8-12)11-6-4-5-7-11/h10-11H,4-9,12H2,1-3H3.
What are the key properties of N'-cyclopentyl-N'-[methyl(propan-2-yl)sulfamoyl]ethane-1,2-diamine?
N'-cyclopentyl-N'-[methyl(propan-2-yl)sulfamoyl]ethane-1,2-diamine has a molecular weight of 263.41 g/mol, XLogP of 0.77, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclopentyl-N'-[methyl(propan-2-yl)sulfamoyl]ethane-1,2-diamine is sourced from PubChem (CID 55242943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).