1-amino-4-methyl-2-[[methyl(propan-2-yl)sulfamoyl]amino]pentane

C10H25N3O2S — CID 63765255

IUPAC1-amino-4-methyl-2-[[methyl(propan-2-yl)sulfamoyl]amino]pentane
SMILESCC(C)CC(CN)NS(=O)(=O)N(C)C(C)C
InChIInChI=1S/C10H25N3O2S/c1-8(2)6-10(7-11)12-16(14,15)13(5)9(3)4/h8-10,12H,6-7,11H2,1-5H3
InChIKeyYNOJEOCMFGUDKD-UHFFFAOYSA-N
MW251.40 g/mol
LogP0.53
Rot. Bonds7

About 1-amino-4-methyl-2-[[methyl(propan-2-yl)sulfamoyl]amino]pentane

1-amino-4-methyl-2-[[methyl(propan-2-yl)sulfamoyl]amino]pentane (PubChem CID 63765255) has the molecular formula C10H25N3O2S and a molecular weight of 251.40 g/mol. Its IUPAC name is 1-amino-4-methyl-2-[[methyl(propan-2-yl)sulfamoyl]amino]pentane.

Molecular Properties

Compound Name1-amino-4-methyl-2-[[methyl(propan-2-yl)sulfamoyl]amino]pentane
PubChem CID63765255
Molecular FormulaC10H25N3O2S
Molecular Weight251.40 g/mol
Exact Mass251.17
IUPAC Name1-amino-4-methyl-2-[[methyl(propan-2-yl)sulfamoyl]amino]pentane
SMILESCC(C)CC(CN)NS(=O)(=O)N(C)C(C)C
InChIInChI=1S/C10H25N3O2S/c1-8(2)6-10(7-11)12-16(14,15)13(5)9(3)4/h8-10,12H,6-7,11H2,1-5H3
InChIKeyYNOJEOCMFGUDKD-UHFFFAOYSA-N
XLogP0.53
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.40
LogP ≤ 50.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-amino-4-methyl-2-[[methyl(propan-2-yl)sulfamoyl]amino]pentane?
The IUPAC name of 1-amino-4-methyl-2-[[methyl(propan-2-yl)sulfamoyl]amino]pentane (CID 63765255) is 1-amino-4-methyl-2-[[methyl(propan-2-yl)sulfamoyl]amino]pentane.
What is the SMILES notation for 1-amino-4-methyl-2-[[methyl(propan-2-yl)sulfamoyl]amino]pentane?
The canonical SMILES for 1-amino-4-methyl-2-[[methyl(propan-2-yl)sulfamoyl]amino]pentane is CC(C)CC(CN)NS(=O)(=O)N(C)C(C)C.
What is the InChIKey of 1-amino-4-methyl-2-[[methyl(propan-2-yl)sulfamoyl]amino]pentane?
The InChIKey is YNOJEOCMFGUDKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H25N3O2S/c1-8(2)6-10(7-11)12-16(14,15)13(5)9(3)4/h8-10,12H,6-7,11H2,1-5H3.
What are the key properties of 1-amino-4-methyl-2-[[methyl(propan-2-yl)sulfamoyl]amino]pentane?
1-amino-4-methyl-2-[[methyl(propan-2-yl)sulfamoyl]amino]pentane has a molecular weight of 251.40 g/mol, XLogP of 0.53, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-4-methyl-2-[[methyl(propan-2-yl)sulfamoyl]amino]pentane is sourced from PubChem (CID 63765255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).