1-(aminomethyl)-1-[(sulfamoylamino)methyl]cyclohexane

C8H19N3O2S — CID 114959634

IUPAC1-(aminomethyl)-1-[(sulfamoylamino)methyl]cyclohexane
SMILESNCC1(CNS(N)(=O)=O)CCCCC1
InChIInChI=1S/C8H19N3O2S/c9-6-8(4-2-1-3-5-8)7-11-14(10,12)13/h11H,1-7,9H2,(H2,10,12,13)
InChIKeyNZSXRCCVDNHVHR-UHFFFAOYSA-N
MW221.33 g/mol
LogP-0.31
Rot. Bonds4

About 1-(aminomethyl)-1-[(sulfamoylamino)methyl]cyclohexane

1-(aminomethyl)-1-[(sulfamoylamino)methyl]cyclohexane (PubChem CID 114959634) has the molecular formula C8H19N3O2S and a molecular weight of 221.33 g/mol. Its IUPAC name is 1-(aminomethyl)-1-[(sulfamoylamino)methyl]cyclohexane.

Molecular Properties

Compound Name1-(aminomethyl)-1-[(sulfamoylamino)methyl]cyclohexane
PubChem CID114959634
Molecular FormulaC8H19N3O2S
Molecular Weight221.33 g/mol
Exact Mass221.12
IUPAC Name1-(aminomethyl)-1-[(sulfamoylamino)methyl]cyclohexane
SMILESNCC1(CNS(N)(=O)=O)CCCCC1
InChIInChI=1S/C8H19N3O2S/c9-6-8(4-2-1-3-5-8)7-11-14(10,12)13/h11H,1-7,9H2,(H2,10,12,13)
InChIKeyNZSXRCCVDNHVHR-UHFFFAOYSA-N
XLogP-0.31
TPSA98.21 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.33
LogP ≤ 5-0.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 1-(aminomethyl)-1-[(sulfamoylamino)methyl]cyclohexane 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-(Aminomethyl)cyclohexyl]methanamine
CID 71994
Spiroplatin
CID 23725025
Platinum(4+) sulfate (cyclohexane-1,1-diyl)dimethanaminide (1/1/1)
CID 9802804
N-[[1-(aminomethyl)cyclohexyl]methylsulfamoyl]-2,2,2-trifluoroethanamine
CID 114812939
[1-(Aminomethyl)cyclohexyl]methanamine;platinum;sulfuric acid
CID 11947754
(1-Methylcyclohexyl)methylsulfamic acid
CID 23197363
CID 24199037
CID 24199037
1-(3,3-Dimethylbutyl)-4-[(sulfamoylamino)methyl]cyclohexane
CID 162101140
CID 5464340
CID 5464340
[1-(Aminomethyl)cyclohexyl]methanamine;platinum(2+);sulfuric acid
CID 9889174
1-Propyl-1-[(sulfamoylamino)methyl]cyclohexane
CID 10014280
1-Methyl-1-[(sulfamoylamino)methyl]cyclohexane
CID 103753229

Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-1-[(sulfamoylamino)methyl]cyclohexane?
The IUPAC name of 1-(aminomethyl)-1-[(sulfamoylamino)methyl]cyclohexane (CID 114959634) is 1-(aminomethyl)-1-[(sulfamoylamino)methyl]cyclohexane.
What is the SMILES notation for 1-(aminomethyl)-1-[(sulfamoylamino)methyl]cyclohexane?
The canonical SMILES for 1-(aminomethyl)-1-[(sulfamoylamino)methyl]cyclohexane is NCC1(CNS(N)(=O)=O)CCCCC1.
What is the InChIKey of 1-(aminomethyl)-1-[(sulfamoylamino)methyl]cyclohexane?
The InChIKey is NZSXRCCVDNHVHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19N3O2S/c9-6-8(4-2-1-3-5-8)7-11-14(10,12)13/h11H,1-7,9H2,(H2,10,12,13).
What are the key properties of 1-(aminomethyl)-1-[(sulfamoylamino)methyl]cyclohexane?
1-(aminomethyl)-1-[(sulfamoylamino)methyl]cyclohexane has a molecular weight of 221.33 g/mol, XLogP of -0.31, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-1-[(sulfamoylamino)methyl]cyclohexane is sourced from PubChem (CID 114959634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).