1-(aminomethyl)-1-(sulfamoylamino)cyclohexane

C7H17N3O2S — CID 28940492

IUPAC1-(aminomethyl)-1-(sulfamoylamino)cyclohexane
SMILESNCC1(NS(N)(=O)=O)CCCCC1
InChIInChI=1S/C7H17N3O2S/c8-6-7(10-13(9,11)12)4-2-1-3-5-7/h10H,1-6,8H2,(H2,9,11,12)
InChIKeyBUJZJJAJWHCDRB-UHFFFAOYSA-N
MW207.30 g/mol
LogP-0.56
Rot. Bonds3

About 1-(aminomethyl)-1-(sulfamoylamino)cyclohexane

1-(aminomethyl)-1-(sulfamoylamino)cyclohexane (PubChem CID 28940492) has the molecular formula C7H17N3O2S and a molecular weight of 207.30 g/mol. Its IUPAC name is 1-(aminomethyl)-1-(sulfamoylamino)cyclohexane.

Molecular Properties

Compound Name1-(aminomethyl)-1-(sulfamoylamino)cyclohexane
PubChem CID28940492
Molecular FormulaC7H17N3O2S
Molecular Weight207.30 g/mol
Exact Mass207.10
IUPAC Name1-(aminomethyl)-1-(sulfamoylamino)cyclohexane
SMILESNCC1(NS(N)(=O)=O)CCCCC1
InChIInChI=1S/C7H17N3O2S/c8-6-7(10-13(9,11)12)4-2-1-3-5-7/h10H,1-6,8H2,(H2,9,11,12)
InChIKeyBUJZJJAJWHCDRB-UHFFFAOYSA-N
XLogP-0.56
TPSA98.21 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.30
LogP ≤ 5-0.56
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(aminomethyl)cyclohexyl]methanesulfonamide
CID 16227899
1-Amino-1-[[[ethyl(methyl)sulfamoyl]amino]methyl]cyclohexane
CID 86780507
1-[(2,2,2-Trifluoroethylsulfamoylamino)methyl]cyclohexan-1-amine
CID 113637328
1-(aminomethyl)-N-(2,2,2-trifluoroethylsulfamoyl)cyclohexan-1-amine
CID 114803334
1-[(2,2,2-Trifluoroethylsulfamoylamino)methyl]cyclohexan-1-amine;hydrochloride
CID 121672586
N-(cyclohexylmethyl)aminosulfonamide
CID 17894196
N-[(1-aminocyclohexyl)methyl]methanesulfonamide
CID 43598238
sodium N-[1-(aminomethyl)cyclohexyl]sulfamate
CID 67465541
[1-(Aminomethyl)cyclohexyl]sulfamic acid
CID 67465542
N-(4-methylcyclohexyl)sulfamide
CID 68545910
N-(2-methylheptan-2-ylsulfamoyl)cyclohexanamine
CID 68910877
1-Amino-4-[(sulfamoylamino)methyl]cyclohexane
CID 106126480

Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-1-(sulfamoylamino)cyclohexane?
The IUPAC name of 1-(aminomethyl)-1-(sulfamoylamino)cyclohexane (CID 28940492) is 1-(aminomethyl)-1-(sulfamoylamino)cyclohexane.
What is the SMILES notation for 1-(aminomethyl)-1-(sulfamoylamino)cyclohexane?
The canonical SMILES for 1-(aminomethyl)-1-(sulfamoylamino)cyclohexane is NCC1(NS(N)(=O)=O)CCCCC1.
What is the InChIKey of 1-(aminomethyl)-1-(sulfamoylamino)cyclohexane?
The InChIKey is BUJZJJAJWHCDRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17N3O2S/c8-6-7(10-13(9,11)12)4-2-1-3-5-7/h10H,1-6,8H2,(H2,9,11,12).
What are the key properties of 1-(aminomethyl)-1-(sulfamoylamino)cyclohexane?
1-(aminomethyl)-1-(sulfamoylamino)cyclohexane has a molecular weight of 207.30 g/mol, XLogP of -0.56, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-1-(sulfamoylamino)cyclohexane is sourced from PubChem (CID 28940492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).