1-amino-2-[(sulfamoylamino)methyl]cyclohexane;ethane

C9H23N3O2S — CID 143875603

IUPAC1-amino-2-[(sulfamoylamino)methyl]cyclohexane;ethane
SMILESCC.NC1CCCCC1CNS(N)(=O)=O
InChIInChI=1S/C7H17N3O2S.C2H6/c8-7-4-2-1-3-6(7)5-10-13(9,11)12;1-2/h6-7,10H,1-5,8H2,(H2,9,11,12);1-2H3
InChIKeyWAAOBVPIBCDKDN-UHFFFAOYSA-N
MW237.37 g/mol
LogP0.32
Rot. Bonds3

About 1-amino-2-[(sulfamoylamino)methyl]cyclohexane;ethane

1-amino-2-[(sulfamoylamino)methyl]cyclohexane;ethane (PubChem CID 143875603) has the molecular formula C9H23N3O2S and a molecular weight of 237.37 g/mol. Its IUPAC name is 1-amino-2-[(sulfamoylamino)methyl]cyclohexane;ethane.

Molecular Properties

Compound Name1-amino-2-[(sulfamoylamino)methyl]cyclohexane;ethane
PubChem CID143875603
Molecular FormulaC9H23N3O2S
Molecular Weight237.37 g/mol
Exact Mass237.15
IUPAC Name1-amino-2-[(sulfamoylamino)methyl]cyclohexane;ethane
SMILESCC.NC1CCCCC1CNS(N)(=O)=O
InChIInChI=1S/C7H17N3O2S.C2H6/c8-7-4-2-1-3-6(7)5-10-13(9,11)12;1-2/h6-7,10H,1-5,8H2,(H2,9,11,12);1-2H3
InChIKeyWAAOBVPIBCDKDN-UHFFFAOYSA-N
XLogP0.32
TPSA98.21 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.37
LogP ≤ 50.32
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 1-amino-2-[(sulfamoylamino)methyl]cyclohexane;ethane with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-amino-2-[(sulfamoylamino)methyl]cyclohexane;ethane?
The IUPAC name of 1-amino-2-[(sulfamoylamino)methyl]cyclohexane;ethane (CID 143875603) is 1-amino-2-[(sulfamoylamino)methyl]cyclohexane;ethane.
What is the SMILES notation for 1-amino-2-[(sulfamoylamino)methyl]cyclohexane;ethane?
The canonical SMILES for 1-amino-2-[(sulfamoylamino)methyl]cyclohexane;ethane is CC.NC1CCCCC1CNS(N)(=O)=O.
What is the InChIKey of 1-amino-2-[(sulfamoylamino)methyl]cyclohexane;ethane?
The InChIKey is WAAOBVPIBCDKDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17N3O2S.C2H6/c8-7-4-2-1-3-6(7)5-10-13(9,11)12;1-2/h6-7,10H,1-5,8H2,(H2,9,11,12);1-2H3.
What are the key properties of 1-amino-2-[(sulfamoylamino)methyl]cyclohexane;ethane?
1-amino-2-[(sulfamoylamino)methyl]cyclohexane;ethane has a molecular weight of 237.37 g/mol, XLogP of 0.32, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-2-[(sulfamoylamino)methyl]cyclohexane;ethane is sourced from PubChem (CID 143875603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).