4-[(cyclopropylsulfamoylamino)methyl]cyclohexan-1-amine

C10H21N3O2S — CID 106126319

IUPAC4-[(cyclopropylsulfamoylamino)methyl]cyclohexan-1-amine
SMILESNC1CCC(CNS(=O)(=O)NC2CC2)CC1
InChIInChI=1S/C10H21N3O2S/c11-9-3-1-8(2-4-9)7-12-16(14,15)13-10-5-6-10/h8-10,12-13H,1-7,11H2
InChIKeyKUMJGEBHJPDPGQ-UHFFFAOYSA-N
MW247.36 g/mol
LogP0.09
Rot. Bonds5

About 4-[(cyclopropylsulfamoylamino)methyl]cyclohexan-1-amine

4-[(cyclopropylsulfamoylamino)methyl]cyclohexan-1-amine (PubChem CID 106126319) has the molecular formula C10H21N3O2S and a molecular weight of 247.36 g/mol. Its IUPAC name is 4-[(cyclopropylsulfamoylamino)methyl]cyclohexan-1-amine.

Molecular Properties

Compound Name4-[(cyclopropylsulfamoylamino)methyl]cyclohexan-1-amine
PubChem CID106126319
Molecular FormulaC10H21N3O2S
Molecular Weight247.36 g/mol
Exact Mass247.14
IUPAC Name4-[(cyclopropylsulfamoylamino)methyl]cyclohexan-1-amine
SMILESNC1CCC(CNS(=O)(=O)NC2CC2)CC1
InChIInChI=1S/C10H21N3O2S/c11-9-3-1-8(2-4-9)7-12-16(14,15)13-10-5-6-10/h8-10,12-13H,1-7,11H2
InChIKeyKUMJGEBHJPDPGQ-UHFFFAOYSA-N
XLogP0.09
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.36
LogP ≤ 50.09
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(2,2,2-Trifluoroethylsulfamoylamino)methyl]cyclohexan-1-amine
CID 106126247
N-(cyclohexylmethyl)aminosulfonamide
CID 17894196
4-(aminomethyl)-N-(dimethylsulfamoyl)-N-methylcyclohexan-1-amine
CID 17946855
N-(4-methylcyclohexyl)sulfamate
CID 21124848
1-Amino-4-[(dimethylsulfamoylamino)methyl]cyclohexane
CID 22000435
1-(Dimethylsulfamoylamino)-4-methylcyclohexane
CID 23381127
N-[(1r,4r)-4-(aminomethyl)cyclohexyl]methanesulfonamide
CID 57747895
[(2R)-2-(dimethylsulfamoylamino)propyl]cyclohexane
CID 58923317
N-(4-aminocyclohexylmethyl)methanesulfonamide
CID 59401588
N-(4-methylcyclohexyl)sulfamide
CID 68545910
1-Amino-4-[2-(sulfamoylamino)propan-2-yl]cyclohexane
CID 69423308
4-ethyl-N-(ethylsulfamoyl)cyclohexan-1-amine
CID 70849921

Frequently Asked Questions

What is the IUPAC name of 4-[(cyclopropylsulfamoylamino)methyl]cyclohexan-1-amine?
The IUPAC name of 4-[(cyclopropylsulfamoylamino)methyl]cyclohexan-1-amine (CID 106126319) is 4-[(cyclopropylsulfamoylamino)methyl]cyclohexan-1-amine.
What is the SMILES notation for 4-[(cyclopropylsulfamoylamino)methyl]cyclohexan-1-amine?
The canonical SMILES for 4-[(cyclopropylsulfamoylamino)methyl]cyclohexan-1-amine is NC1CCC(CNS(=O)(=O)NC2CC2)CC1.
What is the InChIKey of 4-[(cyclopropylsulfamoylamino)methyl]cyclohexan-1-amine?
The InChIKey is KUMJGEBHJPDPGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O2S/c11-9-3-1-8(2-4-9)7-12-16(14,15)13-10-5-6-10/h8-10,12-13H,1-7,11H2.
What are the key properties of 4-[(cyclopropylsulfamoylamino)methyl]cyclohexan-1-amine?
4-[(cyclopropylsulfamoylamino)methyl]cyclohexan-1-amine has a molecular weight of 247.36 g/mol, XLogP of 0.09, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(cyclopropylsulfamoylamino)methyl]cyclohexan-1-amine is sourced from PubChem (CID 106126319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).