2-[diamino(methyl)-λ4-sulfanyl]propane

C4H14N2S — CID 163538938

IUPAC2-[diamino(methyl)-λ4-sulfanyl]propane
SMILESCC(C)S(C)(N)N
InChIInChI=1S/C4H14N2S/c1-4(2)7(3,5)6/h4H,5-6H2,1-3H3
InChIKeyDZJNBYOPNOQQFO-UHFFFAOYSA-N
MW122.24 g/mol
LogP0.58
Rot. Bonds1

About 2-[diamino(methyl)-λ4-sulfanyl]propane

2-[diamino(methyl)-λ4-sulfanyl]propane (PubChem CID 163538938) has the molecular formula C4H14N2S and a molecular weight of 122.24 g/mol. Its IUPAC name is 2-[diamino(methyl)-λ4-sulfanyl]propane.

Molecular Properties

Compound Name2-[diamino(methyl)-λ4-sulfanyl]propane
PubChem CID163538938
Molecular FormulaC4H14N2S
Molecular Weight122.24 g/mol
Exact Mass122.09
IUPAC Name2-[diamino(methyl)-λ4-sulfanyl]propane
SMILESCC(C)S(C)(N)N
InChIInChI=1S/C4H14N2S/c1-4(2)7(3,5)6/h4H,5-6H2,1-3H3
InChIKeyDZJNBYOPNOQQFO-UHFFFAOYSA-N
XLogP0.58
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.24
LogP ≤ 50.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-[diamino(methyl)-λ4-sulfanyl]propane 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

2-methylsulfonylpropane
CID 163990602
[amino(dichloro)-λ4-sulfanyl]methane
CID 118359678
CID 160921753
CID 160921753
imino-methyl-oxo-propan-2-yl-λ6-sulfane;imino-methyl-oxo-propan-2-yl-λ6-sulfane
CID 165047245
methanesulfonamide;dihydrochloride
CID 23102685
CID 160957536
CID 160957536
propan-2-yloxymethanesulfonamide
CID 79576314
3-N-methyl-3-N-(2-methylsulfonylethyl)butane-2,3-diamine
CID 79850078
2-(N-amino-S-propan-2-ylsulfonimidoyl)propane
CID 167144720
N-propan-2-ylmethanesulfonohydrazide
CID 18735133
ethyl-methyl-propan-2-yl-sulfanyl-λ4-sulfane
CID 155261283
(amino-hydroxy-methyl-λ4-sulfanyl)cyclopropane
CID 123506114

Frequently Asked Questions

What is the IUPAC name of 2-[diamino(methyl)-λ4-sulfanyl]propane?
The IUPAC name of 2-[diamino(methyl)-λ4-sulfanyl]propane (CID 163538938) is 2-[diamino(methyl)-λ4-sulfanyl]propane.
What is the SMILES notation for 2-[diamino(methyl)-λ4-sulfanyl]propane?
The canonical SMILES for 2-[diamino(methyl)-λ4-sulfanyl]propane is CC(C)S(C)(N)N.
What is the InChIKey of 2-[diamino(methyl)-λ4-sulfanyl]propane?
The InChIKey is DZJNBYOPNOQQFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H14N2S/c1-4(2)7(3,5)6/h4H,5-6H2,1-3H3.
What are the key properties of 2-[diamino(methyl)-λ4-sulfanyl]propane?
2-[diamino(methyl)-λ4-sulfanyl]propane has a molecular weight of 122.24 g/mol, XLogP of 0.58, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[diamino(methyl)-λ4-sulfanyl]propane is sourced from PubChem (CID 163538938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).