2-amino-1-(diethylsulfamoylamino)-4-methylpentane

C10H25N3O2S — CID 43606400

IUPAC2-amino-1-(diethylsulfamoylamino)-4-methylpentane
SMILESCCN(CC)S(=O)(=O)NCC(N)CC(C)C
InChIInChI=1S/C10H25N3O2S/c1-5-13(6-2)16(14,15)12-8-10(11)7-9(3)4/h9-10,12H,5-8,11H2,1-4H3
InChIKeyZGHJXSTZKVXYDP-UHFFFAOYSA-N
MW251.40 g/mol
LogP0.54
Rot. Bonds8

About 2-amino-1-(diethylsulfamoylamino)-4-methylpentane

2-amino-1-(diethylsulfamoylamino)-4-methylpentane (PubChem CID 43606400) has the molecular formula C10H25N3O2S and a molecular weight of 251.40 g/mol. Its IUPAC name is 2-amino-1-(diethylsulfamoylamino)-4-methylpentane.

Molecular Properties

Compound Name2-amino-1-(diethylsulfamoylamino)-4-methylpentane
PubChem CID43606400
Molecular FormulaC10H25N3O2S
Molecular Weight251.40 g/mol
Exact Mass251.17
IUPAC Name2-amino-1-(diethylsulfamoylamino)-4-methylpentane
SMILESCCN(CC)S(=O)(=O)NCC(N)CC(C)C
InChIInChI=1S/C10H25N3O2S/c1-5-13(6-2)16(14,15)12-8-10(11)7-9(3)4/h9-10,12H,5-8,11H2,1-4H3
InChIKeyZGHJXSTZKVXYDP-UHFFFAOYSA-N
XLogP0.54
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.40
LogP ≤ 50.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-amino-1-(diethylsulfamoylamino)-4-methylpentane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

CID 154708554
CID 154708554
2-Methyl-4-[methyl(methylsulfamoyl)amino]pentane
CID 154708555
1-(Dimethylsulfamoylamino)-4-methylpentane
CID 21021023
4-methyl-N-(propan-2-ylsulfamoyl)pentan-1-amine
CID 22966185
(2S)-1-N-(dimethylsulfamoyl)-1-N,3-dimethyl-2-N-propan-2-ylbutane-1,2-diamine
CID 58821550
(2R)-2-(dimethylsulfamoylamino)-4-methylpentane
CID 58923230
2-Ethyl-3-(3-methylbutyl)-1,2,5-thiadiazolidine 1,1-dioxide
CID 89901773
1-(Dimethylsulfamoylamino)-5-methylhexane
CID 110672096
3-methyl-1-N-[3-methyl-2-(sulfonylamino)butyl]butane-1,2-diamine
CID 142660514
(2R)-2-[[butan-2-yl(methyl)sulfamoyl]amino]-4-methylpentane
CID 143144135
Ethane;4-methyl-2-[(sulfamoylamino)methyl]pyrrolidine
CID 144551907
methane;4-methyl-N-(propan-2-ylsulfamoyl)pentan-1-amine
CID 160469218

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(diethylsulfamoylamino)-4-methylpentane?
The IUPAC name of 2-amino-1-(diethylsulfamoylamino)-4-methylpentane (CID 43606400) is 2-amino-1-(diethylsulfamoylamino)-4-methylpentane.
What is the SMILES notation for 2-amino-1-(diethylsulfamoylamino)-4-methylpentane?
The canonical SMILES for 2-amino-1-(diethylsulfamoylamino)-4-methylpentane is CCN(CC)S(=O)(=O)NCC(N)CC(C)C.
What is the InChIKey of 2-amino-1-(diethylsulfamoylamino)-4-methylpentane?
The InChIKey is ZGHJXSTZKVXYDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H25N3O2S/c1-5-13(6-2)16(14,15)12-8-10(11)7-9(3)4/h9-10,12H,5-8,11H2,1-4H3.
What are the key properties of 2-amino-1-(diethylsulfamoylamino)-4-methylpentane?
2-amino-1-(diethylsulfamoylamino)-4-methylpentane has a molecular weight of 251.40 g/mol, XLogP of 0.54, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(diethylsulfamoylamino)-4-methylpentane is sourced from PubChem (CID 43606400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).