2-amino-1-hydroxy-3-(sulfamoylamino)propane

C3H11N3O3S — CID 117275890

IUPAC2-amino-1-hydroxy-3-(sulfamoylamino)propane
SMILESNC(CO)CNS(N)(=O)=O
InChIInChI=1S/C3H11N3O3S/c4-3(2-7)1-6-10(5,8)9/h3,6-7H,1-2,4H2,(H2,5,8,9)
InChIKeyKTLZVPABTTZCSF-UHFFFAOYSA-N
MW169.21 g/mol
LogP-2.90
Rot. Bonds4

About 2-amino-1-hydroxy-3-(sulfamoylamino)propane

2-amino-1-hydroxy-3-(sulfamoylamino)propane (PubChem CID 117275890) has the molecular formula C3H11N3O3S and a molecular weight of 169.21 g/mol. Its IUPAC name is 2-amino-1-hydroxy-3-(sulfamoylamino)propane.

Molecular Properties

Compound Name2-amino-1-hydroxy-3-(sulfamoylamino)propane
PubChem CID117275890
Molecular FormulaC3H11N3O3S
Molecular Weight169.21 g/mol
Exact Mass169.05
IUPAC Name2-amino-1-hydroxy-3-(sulfamoylamino)propane
SMILESNC(CO)CNS(N)(=O)=O
InChIInChI=1S/C3H11N3O3S/c4-3(2-7)1-6-10(5,8)9/h3,6-7H,1-2,4H2,(H2,5,8,9)
InChIKeyKTLZVPABTTZCSF-UHFFFAOYSA-N
XLogP-2.90
TPSA118.44 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.21
LogP ≤ 5-2.90
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

1-hydroxy-2-methyl-3-(sulfamoylamino)propane
CID 112689052
[1-amino-2-(sulfamoylamino)ethyl]cyclopropane
CID 114959424
methyl 2-amino-3-(sulfamoylamino)propanoate
CID 117275888
(2S)-1-hydroxy-3-methyl-2-(sulfamoylamino)butane
CID 103736172
(2R)-2-amino-3-(propan-2-ylamino)propan-1-ol
CID 58660094
2-amino-3-ethyl-1-(sulfamoylamino)pentane
CID 106286827
1-hydroxy-2-methyl-3-(sulfamoylamino)butane
CID 115643202
[1-cyclopropyl-2-(sulfamoylamino)ethyl]cyclopropane
CID 112695021
2-ethoxy-1-(sulfamoylamino)propane
CID 115650675
3-[(2S)-2-amino-3-hydroxypropyl]-1,1-dimethylurea
CID 10678549
2-hydroxy-1-[2-(sulfamoylamino)ethylamino]propane
CID 114959448
5-methyl-3-[(sulfamoylamino)methyl]hexanoic acid
CID 114958931

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-hydroxy-3-(sulfamoylamino)propane?
The IUPAC name of 2-amino-1-hydroxy-3-(sulfamoylamino)propane (CID 117275890) is 2-amino-1-hydroxy-3-(sulfamoylamino)propane.
What is the SMILES notation for 2-amino-1-hydroxy-3-(sulfamoylamino)propane?
The canonical SMILES for 2-amino-1-hydroxy-3-(sulfamoylamino)propane is NC(CO)CNS(N)(=O)=O.
What is the InChIKey of 2-amino-1-hydroxy-3-(sulfamoylamino)propane?
The InChIKey is KTLZVPABTTZCSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H11N3O3S/c4-3(2-7)1-6-10(5,8)9/h3,6-7H,1-2,4H2,(H2,5,8,9).
What are the key properties of 2-amino-1-hydroxy-3-(sulfamoylamino)propane?
2-amino-1-hydroxy-3-(sulfamoylamino)propane has a molecular weight of 169.21 g/mol, XLogP of -2.90, 4 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-hydroxy-3-(sulfamoylamino)propane is sourced from PubChem (CID 117275890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).