1-hydroxy-4-(sulfamoylamino)pentane

C5H14N2O3S — CID 112698307

IUPAC1-hydroxy-4-(sulfamoylamino)pentane
SMILESCC(CCCO)NS(N)(=O)=O
InChIInChI=1S/C5H14N2O3S/c1-5(3-2-4-8)7-11(6,9)10/h5,7-8H,2-4H2,1H3,(H2,6,9,10)
InChIKeyXTXFHJXLLSFJPB-UHFFFAOYSA-N
MW182.24 g/mol
LogP-1.06
Rot. Bonds5

About 1-hydroxy-4-(sulfamoylamino)pentane

1-hydroxy-4-(sulfamoylamino)pentane (PubChem CID 112698307) has the molecular formula C5H14N2O3S and a molecular weight of 182.24 g/mol. Its IUPAC name is 1-hydroxy-4-(sulfamoylamino)pentane.

Molecular Properties

Compound Name1-hydroxy-4-(sulfamoylamino)pentane
PubChem CID112698307
Molecular FormulaC5H14N2O3S
Molecular Weight182.24 g/mol
Exact Mass182.07
IUPAC Name1-hydroxy-4-(sulfamoylamino)pentane
SMILESCC(CCCO)NS(N)(=O)=O
InChIInChI=1S/C5H14N2O3S/c1-5(3-2-4-8)7-11(6,9)10/h5,7-8H,2-4H2,1H3,(H2,6,9,10)
InChIKeyXTXFHJXLLSFJPB-UHFFFAOYSA-N
XLogP-1.06
TPSA92.42 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.24
LogP ≤ 5-1.06
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 1-hydroxy-4-(sulfamoylamino)pentane 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

1-bromo-N-(5-hydroxypentan-2-yl)methanesulfonamide
CID 83086597
2-(sulfamoylamino)heptane;2,2,2-trifluoroacetic acid
CID 175947630
N-[(2R)-5-hydroxypentan-2-yl]benzenesulfonamide
CID 97051720
(2R)-1-amino-2-(sulfamoylamino)propane;hydrochloride
CID 169235178
5-hydroxypentan-2-ylcarbamic acid
CID 87586302
1-hydroxy-2-methyl-3-(sulfamoylamino)butane
CID 115643202
N-(4-hydroxybutan-2-yl)ethanesulfonamide
CID 78998775
(2S)-1-hydroxy-3-methyl-2-(sulfamoylamino)butane
CID 103736172
(3S,4R)-8-hydroxy-3,4,5-trimethyloctane-2-sulfonamide
CID 137468905
N-[(2R)-5-hydroxypentan-2-yl]-2-(trifluoromethylsulfonyl)benzenesulfonamide
CID 100675221
3-amino-5-chloro-2-fluoro-N-(5-hydroxypentan-2-yl)benzenesulfonamide
CID 103051806
4-amino-3-(5-hydroxypentan-2-ylamino)benzenesulfonamide
CID 82898873

Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-4-(sulfamoylamino)pentane?
The IUPAC name of 1-hydroxy-4-(sulfamoylamino)pentane (CID 112698307) is 1-hydroxy-4-(sulfamoylamino)pentane.
What is the SMILES notation for 1-hydroxy-4-(sulfamoylamino)pentane?
The canonical SMILES for 1-hydroxy-4-(sulfamoylamino)pentane is CC(CCCO)NS(N)(=O)=O.
What is the InChIKey of 1-hydroxy-4-(sulfamoylamino)pentane?
The InChIKey is XTXFHJXLLSFJPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H14N2O3S/c1-5(3-2-4-8)7-11(6,9)10/h5,7-8H,2-4H2,1H3,(H2,6,9,10).
What are the key properties of 1-hydroxy-4-(sulfamoylamino)pentane?
1-hydroxy-4-(sulfamoylamino)pentane has a molecular weight of 182.24 g/mol, XLogP of -1.06, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-4-(sulfamoylamino)pentane is sourced from PubChem (CID 112698307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).